[1-[(1-methyl-2-oxidanylidene-3,4-dihydroquinolin-6-yl)oxy]-3-(4-phenylpiperazin-1-yl)propan-2-yl] propanoate

Systemtic Name: [1-[(1-methyl-2-oxidanylidene-3,4-dihydroquinolin-6-yl)oxy]-3-(4-phenylpiperazin-1-yl)propan-2-yl] propanoate Openeye Name: [1-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)oxymethyl]-2-(4-phenylpiperazin-1-yl)ethyl] propanoate CAS Name: propanoic acid [1-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)oxy]-3-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)oxy]-3-(4-phenylpiperazin-1-yl)propan-2-yl] propanoate Traditional Name: propionic acid [1-[(2-keto-1-methyl-3,4-dihydroquinolin-6-yl)oxymethyl]-2-(4-phenylpiperazino)ethyl] ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(CN1CCN(CC1)C2=CC=CC=C2)COC3=CC4=C(C=C3)N(C(=O)CC4)C

Isomeric SMILES

CCC(=O)OC(CN1CCN(CC1)C2=CC=CC=C2)COC3=CC4=C(C=C3)N(C(=O)CC4)C

InChI

InChI=1S/C26H33N3O4/c1-3-26(31)33-23(18-28-13-15-29(16-14-28)21-7-5-4-6-8-21)19-32-22-10-11-24-20(17-22)9-12-25(30)27(24)2/h4-8,10-11,17,23H,3,9,12-16,18-19H2,1-2H3