methyl (3R)-2-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)carbonyloxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)carbonyloxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-(1-cyclopropyl-2,5-dimethyl-pyrrole-3-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-oxomethoxy]-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-(1-cyclopropyl-2,5-dimethylpyrrole-3-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-(1-cyclopropyl-2,5-dimethyl-pyrrole-3-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)OCC(=O)N3CC4=CC=CC=C4CC3C(=O)OC

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)OCC(=O)N3CC4=CC=CC=C4C[C@@H]3C(=O)OC

InChI

InChI=1S/C23H26N2O5/c1-14-10-19(15(2)25(14)18-8-9-18)22(27)30-13-21(26)24-12-17-7-5-4-6-16(17)11-20(24)23(28)29-3/h4-7,10,18,20H,8-9,11-13H2,1-3H3/t20-/m1/s1