methyl 4-[2-(4-aminophenyl)ethyl-(3-carbamimidoylphenyl)amino]butanoate

Systemtic Name: methyl 4-[2-(4-aminophenyl)ethyl-(3-carbamimidoylphenyl)amino]butanoate Openeye Name: methyl 4-[N-[2-(4-aminophenyl)ethyl]-3-carbamimidoyl-anilino]butanoate CAS Name: 4-[N-[2-(4-aminophenyl)ethyl]-3-carbamimidoylanilino]butanoic acid methyl ester IUPAC Name: methyl 4-[N-[2-(4-aminophenyl)ethyl]-3-carbamimidoylanilino]butanoate Traditional Name: 4-[3-amidino-N-[2-(4-aminophenyl)ethyl]anilino]butyric acid methyl ester Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN(CCC1=CC=C(C=C1)N)C2=CC=CC(=C2)C(=N)N

Isomeric SMILES

COC(=O)CCCN(CCC1=CC=C(C=C1)N)C2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C20H26N4O2/c1-26-19(25)6-3-12-24(13-11-15-7-9-17(21)10-8-15)18-5-2-4-16(14-18)20(22)23/h2,4-5,7-10,14H,3,6,11-13,21H2,1H3,(H3,22,23)