methyl 2-[2-(cyanomethyl)-6-methoxy-4-methyl-phenyl]-7-methoxy-3-oxidanylidene-indene-1-carboxylate

Systemtic Name: methyl 2-[2-(cyanomethyl)-6-methoxy-4-methyl-phenyl]-7-methoxy-3-oxidanylidene-indene-1-carboxylate Openeye Name: methyl 2-[2-(cyanomethyl)-6-methoxy-4-methyl-phenyl]-7-methoxy-3-oxo-indene-1-carboxylate CAS Name: 2-[2-(cyanomethyl)-6-methoxy-4-methylphenyl]-7-methoxy-3-oxo-1-indenecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(cyanomethyl)-6-methoxy-4-methylphenyl]-7-methoxy-3-oxoindene-1-carboxylate Traditional Name: 2-[2-(cyanomethyl)-6-methoxy-4-methyl-phenyl]-3-keto-7-methoxy-indene-1-carboxylic acid methyl ester Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC)C2=C(C3=C(C2=O)C=CC=C3OC)C(=O)OC)CC#N

Isomeric SMILES

CC1=CC(=C(C(=C1)OC)C2=C(C3=C(C2=O)C=CC=C3OC)C(=O)OC)CC#N

InChI

InChI=1S/C22H19NO5/c1-12-10-13(8-9-23)17(16(11-12)27-3)19-20(22(25)28-4)18-14(21(19)24)6-5-7-15(18)26-2/h5-7,10-11H,8H2,1-4H3