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

Systemtic Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-phenyl-propanoate Openeye Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-phenyl-propanoate CAS Name: 3-[[5-(4-carbamimidoylphenyl)-1-oxopentyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-phenylpropanoate Traditional Name: 3-[5-(4-amidinophenyl)pentanoylamino]-3-phenyl-propionic acid ethyl ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3/c1-2-29-22(28)16-20(18-9-4-3-5-10-18)26-21(27)11-7-6-8-17-12-14-19(15-13-17)23(24)25/h3-5,9-10,12-15,20H,2,6-8,11,16H2,1H3,(H3,24,25)(H,26,27)