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

Systemtic Name: (E)-3-benzamido-2-[(3-carbamimidoylphenyl)methyl]-5-phenyl-pent-4-enoic acid Openeye Name: (E)-3-benzamido-2-[(3-carbamimidoylphenyl)methyl]-5-phenyl-pent-4-enoic acid CAS Name: (E)-3-benzamido-2-[(3-carbamimidoylphenyl)methyl]-5-phenyl-4-pentenoic acid IUPAC Name: (E)-3-benzamido-2-[(3-carbamimidoylphenyl)methyl]-5-phenylpent-4-enoic acid Traditional Name: (E)-2-(3-amidinobenzyl)-3-benzamido-5-phenyl-pent-4-enoic acid Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(C(CC2=CC=CC(=C2)C(=N)N)C(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(C(CC2=CC=CC(=C2)C(=N)N)C(=O)O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H25N3O3/c27-24(28)21-13-7-10-19(16-21)17-22(26(31)32)23(15-14-18-8-3-1-4-9-18)29-25(30)20-11-5-2-6-12-20/h1-16,22-23H,17H2,(H3,27,28)(H,29,30)(H,31,32)/b15-14+