O2-tert-butyl O1-ethyl 4-[[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]carbamoyl]-2,3-dihydroindole-1,2-dicarboxylate

Systemtic Name: O2-tert-butyl O1-ethyl 4-[[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]carbamoyl]-2,3-dihydroindole-1,2-dicarboxylate Openeye Name: O2-tert-butyl O1-ethyl 4-[[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]carbamoyl]phenyl]carbamoyl]indoline-1,2-dicarboxylate CAS Name: 4-[[4-[[N,4-dimethyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]anilino]-oxomethyl]-2-methoxyanilino]-oxomethyl]-2,3-dihydroindole-1,2-dicarboxylic acid O2-tert-butyl ester O1-ethyl ester IUPAC Name: 2-O-tert-butyl 1-O-ethyl 4-[[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]carbamoyl]phenyl]carbamoyl]-2,3-dihydroindole-1,2-dicarboxylate Traditional Name: 4-[[4-[[2-[6-keto-6-(4-methylpiperazino)hexoxy]-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-phenyl]carbamoyl]indoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-ethyl ester Formula: C44H57N5O9 MolecularWeight: 799.95148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(CC2=C(C=CC=C21)C(=O)NC3=C(C=C(C=C3)C(=O)N(C)C4=C(C=C(C=C4)C)OCCCCCC(=O)N5CCN(CC5)C)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)N1C(CC2=C(C=CC=C21)C(=O)NC3=C(C=C(C=C3)C(=O)N(C)C4=C(C=C(C=C4)C)OCCCCCC(=O)N5CCN(CC5)C)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C44H57N5O9/c1-9-56-43(54)49-34-15-13-14-31(32(34)28-36(49)42(53)58-44(3,4)5)40(51)45-33-19-18-30(27-37(33)55-8)41(52)47(7)35-20-17-29(2)26-38(35)57-25-12-10-11-16-39(50)48-23-21-46(6)22-24-48/h13-15,17-20,26-27,36H,9-12,16,21-25,28H2,1-8H3,(H,45,51)