3-[(E)-5-(diphenylamino)-5-phenyl-pent-2-enoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one

Systemtic Name: 3-[(E)-5-(diphenylamino)-5-phenyl-pent-2-enoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 2-hydroxy-1-methyl-3-[(E)-5-phenyl-5-(N-phenylanilino)pent-2-enoyl]-3H-quinolin-1-ium-4-one CAS Name: 2-hydroxy-1-methyl-3-[(E)-1-oxo-5-phenyl-5-(N-phenylanilino)pent-2-enyl]-3H-quinolin-1-ium-4-one IUPAC Name: 2-hydroxy-1-methyl-3-[(E)-5-phenyl-5-(N-phenylanilino)pent-2-enoyl]-3H-quinolin-1-ium-4-one Traditional Name: 2-hydroxy-1-methyl-3-[(E)-5-phenyl-5-(N-phenylanilino)pent-2-enoyl]-3H-quinolin-1-ium-4-one Formula: C33H29N2O3+ MolecularWeight: 501.59496

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C33H28N2O3/c1-34-29-21-12-11-20-27(29)32(37)31(33(34)38)30(36)23-13-22-28(24-14-5-2-6-15-24)35(25-16-7-3-8-17-25)26-18-9-4-10-19-26/h2-21,23,28,31H,22H2,1H3/p+1/b23-13+