[5-[2-(ethylamino)-1-oxidanyl-butyl]-2-oxidanylidene-1H-quinolin-8-yl] 4-methylbenzoate

Systemtic Name: [5-[2-(ethylamino)-1-oxidanyl-butyl]-2-oxidanylidene-1H-quinolin-8-yl] 4-methylbenzoate Openeye Name: [5-[2-(ethylamino)-1-hydroxy-butyl]-2-oxo-1H-quinolin-8-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [5-[2-(ethylamino)-1-hydroxybutyl]-2-oxo-1H-quinolin-8-yl] ester IUPAC Name: [5-[2-(ethylamino)-1-hydroxybutyl]-2-oxo-1H-quinolin-8-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [5-[2-(ethylamino)-1-hydroxy-butyl]-2-keto-1H-quinolin-8-yl] ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)C)O)NCC

Isomeric SMILES

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)C)O)NCC

InChI

InChI=1S/C23H26N2O4/c1-4-18(24-5-2)22(27)17-10-12-19(21-16(17)11-13-20(26)25-21)29-23(28)15-8-6-14(3)7-9-15/h6-13,18,22,24,27H,4-5H2,1-3H3,(H,25,26)