methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylaminomethyl)phenyl]benzoate

Systemtic Name: methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylaminomethyl)phenyl]benzoate Openeye Name: methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylaminomethyl)phenyl]benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-(methylaminomethyl)phenyl]benzoic acid methoxymethyl ester IUPAC Name: methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylaminomethyl)phenyl]benzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-4-(methylaminomethyl)phenyl]benzoic acid methoxymethyl ester Formula: C25H26N4O4 MolecularWeight: 446.49834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)OCOC)C(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CNCC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)OCOC)C(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C25H26N4O4/c1-28-14-16-7-12-20(19-5-3-4-6-21(19)25(31)33-15-32-2)22(13-16)24(30)29-18-10-8-17(9-11-18)23(26)27/h3-13,28H,14-15H2,1-2H3,(H3,26,27)(H,29,30)