methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-chloranyl-phenyl]-5-methyl-benzoate

Systemtic Name: methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-chloranyl-phenyl]-5-methyl-benzoate Openeye Name: methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-chloro-phenyl]-5-methyl-benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-5-chlorophenyl]-5-methylbenzoic acid methoxymethyl ester IUPAC Name: methoxymethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-chlorophenyl]-5-methylbenzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-5-chloro-phenyl]-5-methyl-benzoic acid methoxymethyl ester Formula: C24H22ClN3O4 MolecularWeight: 451.90218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C=CC(=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OCOC

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C=CC(=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OCOC

InChI

InChI=1S/C24H22ClN3O4/c1-14-3-9-18(21(11-14)24(30)32-13-31-2)20-12-16(25)6-10-19(20)23(29)28-17-7-4-15(5-8-17)22(26)27/h3-12H,13H2,1-2H3,(H3,26,27)(H,28,29)