3-[(4-azanylpiperidin-1-yl)methyl]-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-[(4-azanylpiperidin-1-yl)methyl]-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-[(4-amino-1-piperidyl)methyl]-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-[(4-amino-1-piperidinyl)methyl]-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-[(4-aminopiperidin-1-yl)methyl]-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-[(4-aminopiperidino)methyl]-2-phenyl-cinchoninic acid Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1N)CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C22H23N3O2/c23-16-10-12-25(13-11-16)14-18-20(22(26)27)17-8-4-5-9-19(17)24-21(18)15-6-2-1-3-7-15/h1-9,16H,10-14,23H2,(H,26,27)