methyl 2-[2-[4-[bis(azanyl)methylideneamino]phenyl]ethyl-(3-carbamimidoylphenyl)amino]ethanoate

Systemtic Name: methyl 2-[2-[4-[bis(azanyl)methylideneamino]phenyl]ethyl-(3-carbamimidoylphenyl)amino]ethanoate Openeye Name: methyl 2-[3-carbamimidoyl-N-[2-(4-guanidinophenyl)ethyl]anilino]acetate CAS Name: 2-[3-carbamimidoyl-N-[2-[4-(diaminomethylideneamino)phenyl]ethyl]anilino]acetic acid methyl ester IUPAC Name: methyl 2-[3-carbamimidoyl-N-[2-[4-(diaminomethylideneamino)phenyl]ethyl]anilino]acetate Traditional Name: 2-[3-amidino-N-[2-(4-guanidinophenyl)ethyl]anilino]acetic acid methyl ester Formula: C19H24N6O2 MolecularWeight: 368.43286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N6O2/c1-27-17(26)12-25(16-4-2-3-14(11-16)18(20)21)10-9-13-5-7-15(8-6-13)24-19(22)23/h2-8,11H,9-10,12H2,1H3,(H3,20,21)(H4,22,23,24)