ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-phenyl-butanoate

Systemtic Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-phenyl-butanoate Openeye Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-phenyl-butanoate CAS Name: 3-[[5-(4-carbamimidoylphenyl)-1-oxopentyl]amino]-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-phenylbutanoate Traditional Name: 3-[5-(4-amidinophenyl)pentanoylamino]-4-phenyl-butyric acid ethyl ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC1=CC=CC=C1)NC(=O)CCCCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)CC(CC1=CC=CC=C1)NC(=O)CCCCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C24H31N3O3/c1-2-30-23(29)17-21(16-19-9-4-3-5-10-19)27-22(28)11-7-6-8-18-12-14-20(15-13-18)24(25)26/h3-5,9-10,12-15,21H,2,6-8,11,16-17H2,1H3,(H3,25,26)(H,27,28)