methyl 2-(2,2-diphenylethanoyl)-5-methyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(2,2-diphenylethanoyl)-5-methyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-(2,2-diphenylacetyl)-5-methyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 5-methyl-2-(1-oxo-2,2-diphenylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(2,2-diphenylacetyl)-5-methyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-(2,2-diphenylacetyl)-5-methyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1CC(N(C2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC=CC2=C1CC(N(C2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C26H25NO3/c1-18-10-9-15-21-17-27(23(16-22(18)21)26(29)30-2)25(28)24(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-15,23-24H,16-17H2,1-2H3