methyl 4-[[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate CAS Name: 4-[[[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methyl-1-piperazinyl)ethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]carbamoyl]benzoate Traditional Name: 4-[[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazino)ethyl]carbamoyl]benzoic acid methyl ester Formula: C26H34N4O3 MolecularWeight: 450.57316

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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(CCC4)C

Isomeric SMILES

CN1CCN(CC1)C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)C3=CC4=C(C=C3)N(CCC4)C

InChI

InChI=1S/C26H34N4O3/c1-28-13-15-30(16-14-28)24(22-10-11-23-21(17-22)5-4-12-29(23)2)18-27-25(31)19-6-8-20(9-7-19)26(32)33-3/h6-11,17,24H,4-5,12-16,18H2,1-3H3,(H,27,31)