ethyl 2-[4-[4-oxidanylidene-4-(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)butyl]piperazin-1-yl]benzoate

Systemtic Name: ethyl 2-[4-[4-oxidanylidene-4-(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)butyl]piperazin-1-yl]benzoate Openeye Name: ethyl 2-[4-[4-oxo-4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)butyl]piperazin-1-yl]benzoate CAS Name: 2-[4-[4-oxo-4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)butyl]-1-piperazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[4-[4-oxo-4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)butyl]piperazin-1-yl]benzoate Traditional Name: 2-[4-[4-keto-4-(2-keto-3,4-dihydro-1H-quinolin-6-yl)butyl]piperazino]benzoic acid ethyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1N2CCN(CC2)CCCC(=O)C3=CC4=C(C=C3)NC(=O)CC4

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1N2CCN(CC2)CCCC(=O)C3=CC4=C(C=C3)NC(=O)CC4

InChI

InChI=1S/C26H31N3O4/c1-2-33-26(32)21-6-3-4-7-23(21)29-16-14-28(15-17-29)13-5-8-24(30)20-9-11-22-19(18-20)10-12-25(31)27-22/h3-4,6-7,9,11,18H,2,5,8,10,12-17H2,1H3,(H,27,31)