4-[1-azanyl-4-methoxy-1-oxidanylidene-2-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid

Systemtic Name: 4-[1-azanyl-4-methoxy-1-oxidanylidene-2-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid Openeye Name: 4-[1-carbamoyl-3-methoxy-1-[2-(1-piperidyl)phenyl]propyl]benzoic acid CAS Name: 4-[1-amino-4-methoxy-1-oxo-2-[2-(1-piperidinyl)phenyl]butan-2-yl]benzoic acid IUPAC Name: 4-[1-amino-4-methoxy-1-oxo-2-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid Traditional Name: 4-[1-carbamoyl-3-methoxy-1-(2-piperidinophenyl)propyl]benzoic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(C1=CC=C(C=C1)C(=O)O)(C2=CC=CC=C2N3CCCCC3)C(=O)N

Isomeric SMILES

COCCC(C1=CC=C(C=C1)C(=O)O)(C2=CC=CC=C2N3CCCCC3)C(=O)N

InChI

InChI=1S/C23H28N2O4/c1-29-16-13-23(22(24)28,18-11-9-17(10-12-18)21(26)27)19-7-3-4-8-20(19)25-14-5-2-6-15-25/h3-4,7-12H,2,5-6,13-16H2,1H3,(H2,24,28)(H,26,27)