(E)-3-benzamido-2-[(3-isocyanophenyl)methyl]-5-phenyl-pent-4-enoic acid

Systemtic Name: (E)-3-benzamido-2-[(3-isocyanophenyl)methyl]-5-phenyl-pent-4-enoic acid Openeye Name: (E)-3-benzamido-2-[(3-isocyanophenyl)methyl]-5-phenyl-pent-4-enoic acid CAS Name: (E)-3-benzamido-2-[(3-isocyanophenyl)methyl]-5-phenyl-4-pentenoic acid IUPAC Name: (E)-3-benzamido-2-[(3-isocyanophenyl)methyl]-5-phenylpent-4-enoic acid Traditional Name: (E)-3-benzamido-2-(3-isocyanobenzyl)-5-phenyl-pent-4-enoic acid Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=CC(=C1)CC(C(C=CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

[C-]#[N+]C1=CC=CC(=C1)CC(C(/C=C/C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H22N2O3/c1-27-22-14-8-11-20(17-22)18-23(26(30)31)24(16-15-19-9-4-2-5-10-19)28-25(29)21-12-6-3-7-13-21/h2-17,23-24H,18H2,(H,28,29)(H,30,31)/b16-15+