methyl 3-(aminomethyl)-3-(methoxycarbonylamino)cycloheptane-1-carboxylate

Systemtic Name: methyl 3-(aminomethyl)-3-(methoxycarbonylamino)cycloheptane-1-carboxylate Openeye Name: methyl 3-(aminomethyl)-3-(methoxycarbonylamino)cycloheptanecarboxylate CAS Name: 3-(aminomethyl)-3-(methoxycarbonylamino)-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 3-(aminomethyl)-3-(methoxycarbonylamino)cycloheptane-1-carboxylate Traditional Name: 3-(aminomethyl)-3-(carbomethoxyamino)cycloheptanecarboxylic acid methyl ester Formula: C12H22N2O4 MolecularWeight: 258.31408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCCC(C1)(CN)NC(=O)OC

Isomeric SMILES

COC(=O)C1CCCCC(C1)(CN)NC(=O)OC

InChI

InChI=1S/C12H22N2O4/c1-17-10(15)9-5-3-4-6-12(7-9,8-13)14-11(16)18-2/h9H,3-8,13H2,1-2H3,(H,14,16)