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

Systemtic Name: methyl 2-[2-(4-aminophenyl)ethyl-(3-carbamimidoylphenyl)amino]ethanoate Openeye Name: methyl 2-[N-[2-(4-aminophenyl)ethyl]-3-carbamimidoyl-anilino]acetate CAS Name: 2-[N-[2-(4-aminophenyl)ethyl]-3-carbamimidoylanilino]acetic acid methyl ester IUPAC Name: methyl 2-[N-[2-(4-aminophenyl)ethyl]-3-carbamimidoylanilino]acetate Traditional Name: 2-[3-amidino-N-[2-(4-aminophenyl)ethyl]anilino]acetic acid methyl ester Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O2/c1-24-17(23)12-22(10-9-13-5-7-15(19)8-6-13)16-4-2-3-14(11-16)18(20)21/h2-8,11H,9-10,12,19H2,1H3,(H3,20,21)