3-[[(E)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enoyl]amino]propylcarbamic acid

Systemtic Name: 3-[[(E)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enoyl]amino]propylcarbamic acid Openeye Name: 3-[[(E)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enoyl]amino]propylcarbamic acid CAS Name: 3-[[(E)-1-oxo-4-[[oxo-(4-phenylanilino)methyl]amino]-5-phenylpent-2-enyl]amino]propylcarbamic acid IUPAC Name: 3-[[(E)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enoyl]amino]propylcarbamic acid Traditional Name: 3-[[(E)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enoyl]amino]propylcarbamic acid Formula: C28H30N4O4 MolecularWeight: 486.5622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C=CC(=O)NCCCNC(=O)O)NC(=O)NC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(/C=C/C(=O)NCCCNC(=O)O)NC(=O)NC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H30N4O4/c33-26(29-18-7-19-30-28(35)36)17-16-25(20-21-8-3-1-4-9-21)32-27(34)31-24-14-12-23(13-15-24)22-10-5-2-6-11-22/h1-6,8-17,25,30H,7,18-20H2,(H,29,33)(H,35,36)(H2,31,32,34)/b17-16+