cyclohexylmethyl 4-[[5-(4-carbamimidoylphenyl)-2-methoxy-phenyl]carbonylamino]cyclohexane-1-carboxylate hydrochloride

Systemtic Name: cyclohexylmethyl 4-[[5-(4-carbamimidoylphenyl)-2-methoxy-phenyl]carbonylamino]cyclohexane-1-carboxylate hydrochloride Openeye Name: cyclohexylmethyl 4-[[5-(4-carbamimidoylphenyl)-2-methoxy-benzoyl]amino]cyclohexanecarboxylate hydrochloride CAS Name: 4-[[[5-(4-carbamimidoylphenyl)-2-methoxyphenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid cyclohexylmethyl ester hydrochloride IUPAC Name: cyclohexylmethyl 4-[[5-(4-carbamimidoylphenyl)-2-methoxybenzoyl]amino]cyclohexane-1-carboxylate hydrochloride Traditional Name: 4-[[5-(4-amidinophenyl)-2-methoxy-benzoyl]amino]cyclohexanecarboxylic acid cyclohexylmethyl ester hydrochloride Formula: C29H38ClN3O4 MolecularWeight: 528.08272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=N)N)C(=O)NC3CCC(CC3)C(=O)OCC4CCCCC4.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=N)N)C(=O)NC3CCC(CC3)C(=O)OCC4CCCCC4.Cl

InChI

InChI=1S/C29H37N3O4.ClH/c1-35-26-16-13-23(20-7-9-21(10-8-20)27(30)31)17-25(26)28(33)32-24-14-11-22(12-15-24)29(34)36-18-19-5-3-2-4-6-19;/h7-10,13,16-17,19,22,24H,2-6,11-12,14-15,18H2,1H3,(H3,30,31)(H,32,33);1H