methyl 4-(3,4-dihydroisoquinolin-1-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(3,4-dihydroisoquinolin-1-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(3,4-dihydroisoquinolin-1-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-(3,4-dihydroisoquinolin-1-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(3,4-dihydroisoquinolin-1-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(3,4-dihydroisoquinolin-1-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)OC)C2=NCCC3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)OC)C2=NCCC3=CC=CC=C32

InChI

InChI=1S/C17H18N2O2/c1-10-14(15(11(2)19-10)17(20)21-3)16-13-7-5-4-6-12(13)8-9-18-16/h4-7,19H,8-9H2,1-3H3