[2-oxidanylidene-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-1H-quinolin-8-yl] 2-phenylethanoate

Systemtic Name: [2-oxidanylidene-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-1H-quinolin-8-yl] 2-phenylethanoate Openeye Name: [5-[1-hydroxy-2-(isopropylamino)butyl]-2-oxo-1H-quinolin-8-yl] 2-phenylacetate CAS Name: 2-phenylacetic acid [5-[1-hydroxy-2-(propan-2-ylamino)butyl]-2-oxo-1H-quinolin-8-yl] ester IUPAC Name: [5-[1-hydroxy-2-(propan-2-ylamino)butyl]-2-oxo-1H-quinolin-8-yl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [5-[1-hydroxy-2-(isopropylamino)butyl]-2-keto-1H-quinolin-8-yl] ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)CC3=CC=CC=C3)O)NC(C)C

Isomeric SMILES

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)CC3=CC=CC=C3)O)NC(C)C

InChI

InChI=1S/C24H28N2O4/c1-4-19(25-15(2)3)24(29)18-10-12-20(23-17(18)11-13-21(27)26-23)30-22(28)14-16-8-6-5-7-9-16/h5-13,15,19,24-25,29H,4,14H2,1-3H3,(H,26,27)