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

Systemtic Name: 2-[4-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)carbonyl]piperazin-1-yl]ethyl 3,4-dimethoxybenzoate Openeye Name: 2-[4-(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)piperazin-1-yl]ethyl 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid 2-[4-[oxo-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)piperazin-1-yl]ethyl 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid 2-[4-(2-keto-3,4-dihydro-1H-quinoline-6-carbonyl)piperazino]ethyl ester Formula: C25H29N3O6 MolecularWeight: 467.51426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCCN2CCN(CC2)C(=O)C3=CC4=C(C=C3)NC(=O)CC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCCN2CCN(CC2)C(=O)C3=CC4=C(C=C3)NC(=O)CC4)OC

InChI

InChI=1S/C25H29N3O6/c1-32-21-7-4-19(16-22(21)33-2)25(31)34-14-13-27-9-11-28(12-10-27)24(30)18-3-6-20-17(15-18)5-8-23(29)26-20/h3-4,6-7,15-16H,5,8-14H2,1-2H3,(H,26,29)