(Z)-6-[3-(3-phenylpropanoylamino)phenyl]-6-pyridin-3-yl-hex-5-enoic acid

Systemtic Name: (Z)-6-[3-(3-phenylpropanoylamino)phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (Z)-6-[3-(3-phenylpropanoylamino)phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (Z)-6-[3-[(1-oxo-3-phenylpropyl)amino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (Z)-6-[3-(3-phenylpropanoylamino)phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (Z)-6-[3-(hydrocinnamoylamino)phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC=CC(=C2)C(=CCCCC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC=CC(=C2)/C(=C/CCCC(=O)O)/C3=CN=CC=C3

InChI

InChI=1S/C26H26N2O3/c29-25(16-15-20-8-2-1-3-9-20)28-23-12-6-10-21(18-23)24(13-4-5-14-26(30)31)22-11-7-17-27-19-22/h1-3,6-13,17-19H,4-5,14-16H2,(H,28,29)(H,30,31)/b24-13-