[2-oxidanylidene-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-3,4-dihydro-1H-quinolin-8-yl] 4-methylbenzoate

Systemtic Name: [2-oxidanylidene-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-3,4-dihydro-1H-quinolin-8-yl] 4-methylbenzoate Openeye Name: [5-[1-hydroxy-2-(isopropylamino)butyl]-2-oxo-3,4-dihydro-1H-quinolin-8-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [5-[1-hydroxy-2-(propan-2-ylamino)butyl]-2-oxo-3,4-dihydro-1H-quinolin-8-yl] ester IUPAC Name: [5-[1-hydroxy-2-(propan-2-ylamino)butyl]-2-oxo-3,4-dihydro-1H-quinolin-8-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [5-[1-hydroxy-2-(isopropylamino)butyl]-2-keto-3,4-dihydro-1H-quinolin-8-yl] ester Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2CCC(=O)NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)C)O)NC(C)C

Isomeric SMILES

CCC(C(C1=C2CCC(=O)NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)C)O)NC(C)C

InChI

InChI=1S/C24H30N2O4/c1-5-19(25-14(2)3)23(28)18-10-12-20(22-17(18)11-13-21(27)26-22)30-24(29)16-8-6-15(4)7-9-16/h6-10,12,14,19,23,25,28H,5,11,13H2,1-4H3,(H,26,27)