1-[2-(aminomethyl)-5-propyl-cyclohexyl]azepane-2,7-dione

Systemtic Name: 1-[2-(aminomethyl)-5-propyl-cyclohexyl]azepane-2,7-dione Openeye Name: 1-[2-(aminomethyl)-5-propyl-cyclohexyl]azepane-2,7-dione CAS Name: 1-[2-(aminomethyl)-5-propylcyclohexyl]azepane-2,7-dione IUPAC Name: 1-[2-(aminomethyl)-5-propylcyclohexyl]azepane-2,7-dione Traditional Name: 1-[2-(aminomethyl)-5-propyl-cyclohexyl]azepane-2,7-quinone Formula: C16H28N2O2 MolecularWeight: 280.40572

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(C(C1)N2C(=O)CCCCC2=O)CN

Isomeric SMILES

CCCC1CCC(C(C1)N2C(=O)CCCCC2=O)CN

InChI

InChI=1S/C16H28N2O2/c1-2-5-12-8-9-13(11-17)14(10-12)18-15(19)6-3-4-7-16(18)20/h12-14H,2-11,17H2,1H3