(2S)-1-(3-methylphenyl)-5-oxidanylidene-2-phenyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-4-olate

Systemtic Name: (2S)-1-(3-methylphenyl)-5-oxidanylidene-2-phenyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-4-olate Openeye Name: (2S)-1-(m-tolyl)-5-oxo-2-phenyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-4-olate CAS Name: (2S)-1-(3-methylphenyl)-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-phenyl-2H-pyrrol-4-olate IUPAC Name: (2S)-1-(3-methylphenyl)-5-oxo-2-phenyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-4-olate Traditional Name: (5S)-2-keto-1-(m-tolyl)-5-phenyl-4-[(E)-3-phenylacryloyl]-3-pyrrolin-3-olate Formula: C26H20NO3- MolecularWeight: 394.4419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(C(=C(C2=O)[O-])C(=O)C=CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2[C@H](C(=C(C2=O)[O-])C(=O)/C=C/C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H21NO3/c1-18-9-8-14-21(17-18)27-24(20-12-6-3-7-13-20)23(25(29)26(27)30)22(28)16-15-19-10-4-2-5-11-19/h2-17,24,29H,1H3/p-1/b16-15+/t24-/m0/s1