2-[[phenyl-[2-(pyridin-2-ylcarbonylamino)phenyl]methyl]iminomethyl]-2-prop-2-enyl-pent-4-enoic acid

Systemtic Name: 2-[[phenyl-[2-(pyridin-2-ylcarbonylamino)phenyl]methyl]iminomethyl]-2-prop-2-enyl-pent-4-enoic acid Openeye Name: 2-allyl-2-[[phenyl-[2-(pyridine-2-carbonylamino)phenyl]methyl]iminomethyl]pent-4-enoic acid CAS Name: 2-[[[2-[[oxo(2-pyridinyl)methyl]amino]phenyl]-phenylmethyl]iminomethyl]-2-prop-2-enyl-4-pentenoic acid IUPAC Name: 2-[[phenyl-[2-(pyridine-2-carbonylamino)phenyl]methyl]iminomethyl]-2-prop-2-enylpent-4-enoic acid Traditional Name: 2-allyl-2-[[phenyl-(2-picolinamidophenyl)methyl]iminomethyl]pent-4-enoic acid Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)(C=NC(C1=CC=CC=C1)C2=CC=CC=C2NC(=O)C3=CC=CC=N3)C(=O)O

Isomeric SMILES

C=CCC(CC=C)(C=NC(C1=CC=CC=C1)C2=CC=CC=C2NC(=O)C3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C28H27N3O3/c1-3-17-28(18-4-2,27(33)34)20-30-25(21-12-6-5-7-13-21)22-14-8-9-15-23(22)31-26(32)24-16-10-11-19-29-24/h3-16,19-20,25H,1-2,17-18H2,(H,31,32)(H,33,34)