2-methyl-6-(2-methylphenyl)-3,4,6,8a-tetrahydro-1H-isoquinoline-7,8-dicarboxylate

Systemtic Name: 2-methyl-6-(2-methylphenyl)-3,4,6,8a-tetrahydro-1H-isoquinoline-7,8-dicarboxylate Openeye Name: 2-methyl-6-(o-tolyl)-3,4,6,8a-tetrahydro-1H-isoquinoline-7,8-dicarboxylate CAS Name: 2-methyl-6-(2-methylphenyl)-3,4,6,8a-tetrahydro-1H-isoquinoline-7,8-dicarboxylate IUPAC Name: 2-methyl-6-(2-methylphenyl)-3,4,6,8a-tetrahydro-1H-isoquinoline-7,8-dicarboxylate Traditional Name: 2-methyl-6-(o-tolyl)-3,4,6,8a-tetrahydro-1H-isoquinoline-7,8-dicarboxylate Formula: C19H19NO4-2 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C=C3CCN(CC3C(=C2C(=O)[O-])C(=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1C2C=C3CCN(CC3C(=C2C(=O)[O-])C(=O)[O-])C

InChI

InChI=1S/C19H21NO4/c1-11-5-3-4-6-13(11)14-9-12-7-8-20(2)10-15(12)17(19(23)24)16(14)18(21)22/h3-6,9,14-15H,7-8,10H2,1-2H3,(H,21,22)(H,23,24)/p-2