(Z)-3-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]ethyl]phenyl]but-2-enoate

Systemtic Name: (Z)-3-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]ethyl]phenyl]but-2-enoate Openeye Name: (Z)-3-[4-[2-[(4-carbamimidoylbenzoyl)amino]ethyl]phenyl]but-2-enoate CAS Name: (Z)-3-[4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]ethyl]phenyl]-2-butenoate IUPAC Name: (Z)-3-[4-[2-[(4-carbamimidoylbenzoyl)amino]ethyl]phenyl]but-2-enoate Traditional Name: (Z)-3-[4-[2-[(4-amidinobenzoyl)amino]ethyl]phenyl]but-2-enoate Formula: C20H20N3O3- MolecularWeight: 350.3911

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)[O-])C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C/C(=C/C(=O)[O-])/C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H21N3O3/c1-13(12-18(24)25)15-4-2-14(3-5-15)10-11-23-20(26)17-8-6-16(7-9-17)19(21)22/h2-9,12H,10-11H2,1H3,(H3,21,22)(H,23,26)(H,24,25)/p-1/b13-12-