4-[1-azanyl-3-(5-methyl-2-piperidin-1-yl-phenyl)-1-oxidanylidene-butan-2-yl]benzoic acid

Systemtic Name: 4-[1-azanyl-3-(5-methyl-2-piperidin-1-yl-phenyl)-1-oxidanylidene-butan-2-yl]benzoic acid Openeye Name: 4-[1-carbamoyl-2-[5-methyl-2-(1-piperidyl)phenyl]propyl]benzoic acid CAS Name: 4-[1-amino-3-[5-methyl-2-(1-piperidinyl)phenyl]-1-oxobutan-2-yl]benzoic acid IUPAC Name: 4-[1-amino-3-(5-methyl-2-piperidin-1-ylphenyl)-1-oxobutan-2-yl]benzoic acid Traditional Name: 4-[1-carbamoyl-2-(5-methyl-2-piperidino-phenyl)propyl]benzoic acid Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCCCC2)C(C)C(C3=CC=C(C=C3)C(=O)O)C(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCCCC2)C(C)C(C3=CC=C(C=C3)C(=O)O)C(=O)N

InChI

InChI=1S/C23H28N2O3/c1-15-6-11-20(25-12-4-3-5-13-25)19(14-15)16(2)21(22(24)26)17-7-9-18(10-8-17)23(27)28/h6-11,14,16,21H,3-5,12-13H2,1-2H3,(H2,24,26)(H,27,28)