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

Systemtic Name: methyl (3R)-2-[2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonyloxy]ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-oxomethoxy]-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)OCC(=O)N2CC3=CC=CC=C3CC2C(=O)OC

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)OCC(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)OC

InChI

InChI=1S/C22H24N2O6/c1-12-19(14(3)25)13(2)23-20(12)22(28)30-11-18(26)24-10-16-8-6-5-7-15(16)9-17(24)21(27)29-4/h5-8,17,23H,9-11H2,1-4H3/t17-/m1/s1