1-(phenylcarbonyl)-2H-quinoline-2-carboxylic acid; 1-phenylethanamine

Systemtic Name: 1-(phenylcarbonyl)-2H-quinoline-2-carboxylic acid; 1-phenylethanamine Openeye Name: 1-benzoyl-2H-quinoline-2-carboxylic acid; 1-phenylethanamine CAS Name: 1-benzoyl-2H-quinoline-2-carboxylic acid; 1-phenylethanamine IUPAC Name: 1-benzoyl-2H-quinoline-2-carboxylic acid; 1-phenylethanamine Traditional Name: 1-benzoyl-2H-quinoline-2-carboxylic acid; 1-phenylethylamine Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N.C1=CC=C(C=C1)C(=O)N2C(C=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)N.C1=CC=C(C=C1)C(=O)N2C(C=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H13NO3.C8H11N/c19-16(13-7-2-1-3-8-13)18-14-9-5-4-6-12(14)10-11-15(18)17(20)21;1-7(9)8-5-3-2-4-6-8/h1-11,15H,(H,20,21);2-7H,9H2,1H3