(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(S)-(4-methylphenyl)-phenyl-methyl]azanium

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(S)-(4-methylphenyl)-phenyl-methyl]azanium Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl-[(S)-phenyl(p-tolyl)methyl]ammonium CAS Name: (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl-[(S)-(4-methylphenyl)-phenylmethyl]ammonium IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl-[(S)-(4-methylphenyl)-phenylmethyl]azanium Traditional Name: (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl-[(S)-phenyl(p-tolyl)methyl]ammonium Formula: C25H24NO3+ MolecularWeight: 386.46296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4C)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4C)O

InChI

InChI=1S/C25H23NO3/c1-16-8-10-19(11-9-16)24(18-6-4-3-5-7-18)26-15-20-14-23(28)29-25-17(2)22(27)13-12-21(20)25/h3-14,24,26-27H,15H2,1-2H3/p+1/t24-/m0/s1