4-[[(2-methoxy-5-methyl-phenyl)azaniumyl]methyl]-2-oxidanylidene-7-phenyl-chromen-6-olate

Systemtic Name: 4-[[(2-methoxy-5-methyl-phenyl)azaniumyl]methyl]-2-oxidanylidene-7-phenyl-chromen-6-olate Openeye Name: 4-[[(2-methoxy-5-methyl-phenyl)ammonio]methyl]-2-oxo-7-phenyl-chromen-6-olate CAS Name: 4-[[(2-methoxy-5-methylphenyl)ammonio]methyl]-2-oxo-7-phenyl-1-benzopyran-6-olate IUPAC Name: 4-[[(2-methoxy-5-methylphenyl)azaniumyl]methyl]-2-oxo-7-phenylchromen-6-olate Traditional Name: 2-keto-4-[[(2-methoxy-5-methyl-phenyl)ammonio]methyl]-7-phenyl-chromen-6-olate Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H21NO4/c1-15-8-9-22(28-2)20(10-15)25-14-17-11-24(27)29-23-13-18(21(26)12-19(17)23)16-6-4-3-5-7-16/h3-13,25-26H,14H2,1-2H3