ethyl 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2,4-dimethyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2,4-dimethyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C26H28N2O3/c1-4-31-26(30)24-18(2)25(21-11-6-5-7-12-21)28(19(24)3)17-23(29)27-15-14-20-10-8-9-13-22(20)16-27/h5-13H,4,14-17H2,1-3H3