methyl 4-[[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(1-methylindolin-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate CAS Name: 4-[[[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methyl-1-piperazinyl)ethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate Traditional Name: 4-[[2-(1-methylindolin-5-yl)-2-(4-methylpiperazino)ethyl]carbamoyl]benzoic acid methyl ester Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)C3=CC4=C(C=C3)N(CC4)C

Isomeric SMILES

CN1CCN(CC1)C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)C3=CC4=C(C=C3)N(CC4)C

InChI

InChI=1S/C25H32N4O3/c1-27-12-14-29(15-13-27)23(20-8-9-22-21(16-20)10-11-28(22)2)17-26-24(30)18-4-6-19(7-5-18)25(31)32-3/h4-9,16,23H,10-15,17H2,1-3H3,(H,26,30)