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

Systemtic Name: 1-methyl-3-[(E)-5-(naphthalen-1-ylamino)-5-phenyl-pent-2-enoyl]-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 2-hydroxy-1-methyl-3-[(E)-5-(1-naphthylamino)-5-phenyl-pent-2-enoyl]-3H-quinolin-1-ium-4-one CAS Name: 2-hydroxy-1-methyl-3-[(E)-5-(1-naphthalenylamino)-1-oxo-5-phenylpent-2-enyl]-3H-quinolin-1-ium-4-one IUPAC Name: 2-hydroxy-1-methyl-3-[(E)-5-(naphthalen-1-ylamino)-5-phenylpent-2-enoyl]-3H-quinolin-1-ium-4-one Traditional Name: 2-hydroxy-1-methyl-3-[(E)-5-(1-naphthylamino)-5-phenyl-pent-2-enoyl]-3H-quinolin-1-ium-4-one Formula: C31H27N2O3+ MolecularWeight: 475.55768

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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)NC4=CC=CC5=CC=CC=C54)O

Isomeric SMILES

C[N+]1=C(C(C(=O)C2=CC=CC=C21)C(=O)/C=C/CC(C3=CC=CC=C3)NC4=CC=CC5=CC=CC=C54)O

InChI

InChI=1S/C31H26N2O3/c1-33-27-19-8-7-16-24(27)30(35)29(31(33)36)28(34)20-10-17-25(22-12-3-2-4-13-22)32-26-18-9-14-21-11-5-6-15-23(21)26/h2-16,18-20,25,29,32H,17H2,1H3/p+1/b20-10+