2-(2-methylphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(2-methylphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(2-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[(2-methylphenyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(2-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-o-toluoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CC3=CC=CC=C3CC2C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CC3=CC=CC=C3CC2C(=O)O

InChI

InChI=1S/C18H17NO3/c1-12-6-2-5-9-15(12)17(20)19-11-14-8-4-3-7-13(14)10-16(19)18(21)22/h2-9,16H,10-11H2,1H3,(H,21,22)