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

Systemtic Name: 2-(3-methylphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(3-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[(3-methylphenyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(3-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-m-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(=C1)C(=O)N2CC3=CC=CC=C3CC2C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CC3=CC=CC=C3CC2C(=O)O

InChI

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