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

Systemtic Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-(3-fluorophenyl)propanoate Openeye Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-(3-fluorophenyl)propanoate CAS Name: 3-[[5-(4-carbamimidoylphenyl)-1-oxopentyl]amino]-3-(3-fluorophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-3-(3-fluorophenyl)propanoate Traditional Name: 3-[5-(4-amidinophenyl)pentanoylamino]-3-(3-fluorophenyl)propionic acid ethyl ester Formula: C23H28FN3O3 MolecularWeight: 413.485123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28FN3O3/c1-2-30-22(29)15-20(18-7-5-8-19(24)14-18)27-21(28)9-4-3-6-16-10-12-17(13-11-16)23(25)26/h5,7-8,10-14,20H,2-4,6,9,15H2,1H3,(H3,25,26)(H,27,28)