methyl 2-[4-[(4-carbamimidoylphenyl)carbamoylcarbamoyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[(4-carbamimidoylphenyl)carbamoylcarbamoyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[(4-carbamimidoylphenyl)carbamoylcarbamoyl]phenoxy]acetate CAS Name: 2-[4-[[[(4-carbamimidoylanilino)-oxomethyl]amino]-oxomethyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(4-carbamimidoylphenyl)carbamoylcarbamoyl]phenoxy]acetate Traditional Name: 2-[4-[(4-amidinophenyl)carbamoylcarbamoyl]phenoxy]acetic acid methyl ester Formula: C18H18N4O5 MolecularWeight: 370.35932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C(=O)NC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C(=O)NC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H18N4O5/c1-26-15(23)10-27-14-8-4-12(5-9-14)17(24)22-18(25)21-13-6-2-11(3-7-13)16(19)20/h2-9H,10H2,1H3,(H3,19,20)(H2,21,22,24,25)