[2-(dimethylamino)-2-oxidanylidene-ethyl] 4-[[4-(4-carbamimidoylphenyl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-ethyl] 4-[[4-(4-carbamimidoylphenyl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: [2-(dimethylamino)-2-oxo-ethyl] 4-[[4-(4-carbamimidoylphenyl)piperidine-1-carbonyl]amino]cyclohexanecarboxylate CAS Name: 4-[[[4-(4-carbamimidoylphenyl)-1-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid [2-(dimethylamino)-2-oxoethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxoethyl] 4-[[4-(4-carbamimidoylphenyl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[4-(4-amidinophenyl)piperidine-1-carbonyl]amino]cyclohexanecarboxylic acid [2-(dimethylamino)-2-keto-ethyl] ester Formula: C24H35N5O4 MolecularWeight: 457.5658

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN(C)C(=O)COC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C24H35N5O4/c1-28(2)21(30)15-33-23(31)19-7-9-20(10-8-19)27-24(32)29-13-11-17(12-14-29)16-3-5-18(6-4-16)22(25)26/h3-6,17,19-20H,7-15H2,1-2H3,(H3,25,26)(H,27,32)