methyl 2-(4-dimethylaminophenyl)-6-oxidanyl-2-phenyl-benzo[h]chromene-5-carboxylate

Systemtic Name: methyl 2-(4-dimethylaminophenyl)-6-oxidanyl-2-phenyl-benzo[h]chromene-5-carboxylate Openeye Name: methyl 2-(4-dimethylaminophenyl)-6-hydroxy-2-phenyl-benzo[h]chromene-5-carboxylate CAS Name: 2-(4-dimethylaminophenyl)-6-hydroxy-2-phenyl-5-benzo[h][1]benzopyrancarboxylic acid methyl ester IUPAC Name: methyl 2-(4-dimethylaminophenyl)-6-hydroxy-2-phenylbenzo[h]chromene-5-carboxylate Traditional Name: 2-(4-dimethylaminophenyl)-6-hydroxy-2-phenyl-benzo[h]chromene-5-carboxylic acid methyl ester Formula: C29H25NO4 MolecularWeight: 451.5131

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2(C=CC3=C(O2)C4=CC=CC=C4C(=C3C(=O)OC)O)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2(C=CC3=C(O2)C4=CC=CC=C4C(=C3C(=O)OC)O)C5=CC=CC=C5

InChI

InChI=1S/C29H25NO4/c1-30(2)21-15-13-20(14-16-21)29(19-9-5-4-6-10-19)18-17-24-25(28(32)33-3)26(31)22-11-7-8-12-23(22)27(24)34-29/h4-18,31H,1-3H3