ethyl 3-[[(E)-4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-but-2-enoyl]amino]propanoate

Systemtic Name: ethyl 3-[[(E)-4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-but-2-enoyl]amino]propanoate Openeye Name: ethyl 3-[[(E)-4-(4-carbamimidoylanilino)-4-oxo-but-2-enoyl]amino]propanoate CAS Name: 3-[[(E)-4-(4-carbamimidoylanilino)-1,4-dioxobut-2-enyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[(E)-4-(4-carbamimidoylanilino)-4-oxobut-2-enoyl]amino]propanoate Traditional Name: 3-[[(E)-4-(4-amidinoanilino)-4-keto-but-2-enoyl]amino]propionic acid ethyl ester Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)C=CC(=O)NC1=CC=C(C=C1)C(=N)N

Isomeric SMILES

CCOC(=O)CCNC(=O)/C=C/C(=O)NC1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C16H20N4O4/c1-2-24-15(23)9-10-19-13(21)7-8-14(22)20-12-5-3-11(4-6-12)16(17)18/h3-8H,2,9-10H2,1H3,(H3,17,18)(H,19,21)(H,20,22)/b8-7+