(E)-2-[4-(diphenylcarbamoylamino)phenyl]-6-pyridin-3-yl-hex-5-enoic acid

Systemtic Name: (E)-2-[4-(diphenylcarbamoylamino)phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (E)-2-[4-(diphenylcarbamoylamino)phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (E)-2-[4-[[oxo-(N-phenylanilino)methyl]amino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (E)-2-[4-(diphenylcarbamoylamino)phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (E)-2-[4-(diphenylcarbamoylamino)phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C30H27N3O3 MolecularWeight: 477.55368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(CCC=CC4=CN=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(CC/C=C/C4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C30H27N3O3/c34-29(35)28(16-8-7-10-23-11-9-21-31-22-23)24-17-19-25(20-18-24)32-30(36)33(26-12-3-1-4-13-26)27-14-5-2-6-15-27/h1-7,9-15,17-22,28H,8,16H2,(H,32,36)(H,34,35)/b10-7+