(E)-3-[4-[(1-phenylpiperidin-2-yl)carbonylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(1-phenylpiperidin-2-yl)carbonylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(1-phenylpiperidine-2-carbonyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[oxo-(1-phenyl-2-piperidinyl)methyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(1-phenylpiperidine-2-carbonyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(1-phenylpipecoloyl)amino]phenyl]acrylic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC=C(C=C2)C=CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=CC=C(C=C2)/C=C/C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3/c24-20(25)14-11-16-9-12-17(13-10-16)22-21(26)19-8-4-5-15-23(19)18-6-2-1-3-7-18/h1-3,6-7,9-14,19H,4-5,8,15H2,(H,22,26)(H,24,25)/b14-11+