ethyl 4-[6-[bis(azanyl)methylideneamino]hexanoyloxy]cyclohexane-1-carboxylate; methanesulfonic acid

Systemtic Name: ethyl 4-[6-[bis(azanyl)methylideneamino]hexanoyloxy]cyclohexane-1-carboxylate; methanesulfonic acid Openeye Name: ethyl 4-(6-guanidinohexanoyloxy)cyclohexanecarboxylate; methanesulfonic acid CAS Name: 4-[6-(diaminomethylideneamino)-1-oxohexoxy]-1-cyclohexanecarboxylic acid ethyl ester; methanesulfonic acid IUPAC Name: ethyl 4-[6-(diaminomethylideneamino)hexanoyloxy]cyclohexane-1-carboxylate; methanesulfonic acid Traditional Name: 4-(6-guanidinohexanoyloxy)cyclohexanecarboxylic acid ethyl ester; mesylic acid Formula: C17H33N3O7S MolecularWeight: 423.52482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)OC(=O)CCCCCN=C(N)N.CS(=O)(=O)O

Isomeric SMILES

CCOC(=O)C1CCC(CC1)OC(=O)CCCCCN=C(N)N.CS(=O)(=O)O

InChI

InChI=1S/C16H29N3O4.CH4O3S/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18;1-5(2,3)4/h12-13H,2-11H2,1H3,(H4,17,18,19);1H3,(H,2,3,4)