3-[3-(4-chlorophenyl)-3-(diphenylamino)propanoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one

Systemtic Name: 3-[3-(4-chlorophenyl)-3-(diphenylamino)propanoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 3-[3-(4-chlorophenyl)-3-(N-phenylanilino)propanoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one CAS Name: 3-[3-(4-chlorophenyl)-1-oxo-3-(N-phenylanilino)propyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one IUPAC Name: 3-[3-(4-chlorophenyl)-3-(N-phenylanilino)propanoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one Traditional Name: 3-[3-(4-chlorophenyl)-3-(N-phenylanilino)propanoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one Formula: C31H26ClN2O3+ MolecularWeight: 510.00274

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(C(=O)C2=CC=CC=C21)C(=O)CC(C3=CC=C(C=C3)Cl)N(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

C[N+]1=C(C(C(=O)C2=CC=CC=C21)C(=O)CC(C3=CC=C(C=C3)Cl)N(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C31H25ClN2O3/c1-33-26-15-9-8-14-25(26)30(36)29(31(33)37)28(35)20-27(21-16-18-22(32)19-17-21)34(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-19,27,29H,20H2,1H3/p+1