[2-oxidanylidene-5-(1-oxidanyl-2-pyrrolidin-1-yl-butyl)-3,4-dihydro-1H-quinolin-8-yl] propanoate

Systemtic Name: [2-oxidanylidene-5-(1-oxidanyl-2-pyrrolidin-1-yl-butyl)-3,4-dihydro-1H-quinolin-8-yl] propanoate Openeye Name: [5-(1-hydroxy-2-pyrrolidin-1-yl-butyl)-2-oxo-3,4-dihydro-1H-quinolin-8-yl] propanoate CAS Name: propanoic acid [5-[1-hydroxy-2-(1-pyrrolidinyl)butyl]-2-oxo-3,4-dihydro-1H-quinolin-8-yl] ester IUPAC Name: [5-(1-hydroxy-2-pyrrolidin-1-ylbutyl)-2-oxo-3,4-dihydro-1H-quinolin-8-yl] propanoate Traditional Name: propionic acid [5-(1-hydroxy-2-pyrrolidino-butyl)-2-keto-3,4-dihydro-1H-quinolin-8-yl] ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2CCC(=O)NC2=C(C=C1)OC(=O)CC)O)N3CCCC3

Isomeric SMILES

CCC(C(C1=C2CCC(=O)NC2=C(C=C1)OC(=O)CC)O)N3CCCC3

InChI

InChI=1S/C20H28N2O4/c1-3-15(22-11-5-6-12-22)20(25)14-7-9-16(26-18(24)4-2)19-13(14)8-10-17(23)21-19/h7,9,15,20,25H,3-6,8,10-12H2,1-2H3,(H,21,23)