ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-(4-cyanophenyl)propanoate

Systemtic Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-(4-cyanophenyl)propanoate Openeye Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-(4-cyanophenyl)propanoate CAS Name: 3-[[5-(4-carbamimidoylphenyl)-1-oxopentyl]amino]-3-(4-cyanophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-(4-cyanophenyl)propanoate Traditional Name: 3-[5-(4-amidinophenyl)pentanoylamino]-3-(4-cyanophenyl)propionic acid ethyl ester Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)C#N)NC(=O)CCCCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)CC(C1=CC=C(C=C1)C#N)NC(=O)CCCCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C24H28N4O3/c1-2-31-23(30)15-21(19-11-9-18(16-25)10-12-19)28-22(29)6-4-3-5-17-7-13-20(14-8-17)24(26)27/h7-14,21H,2-6,15H2,1H3,(H3,26,27)(H,28,29)