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

Systemtic Name: 2-(4-chlorophenyl)carbonyl-3,4-dihydro-1H-isoquinoline-1-carboxylic acid Openeye Name: 2-(4-chlorobenzoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-1-carboxylic acid IUPAC Name: 2-(4-chlorobenzoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid Traditional Name: 2-(4-chlorobenzoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid Formula: C17H14ClNO3 MolecularWeight: 315.75096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClNO3/c18-13-7-5-12(6-8-13)16(20)19-10-9-11-3-1-2-4-14(11)15(19)17(21)22/h1-8,15H,9-10H2,(H,21,22)