13-azanyl-13-(2-azanyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)tridecanoic acid

Systemtic Name: 13-azanyl-13-(2-azanyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)tridecanoic acid Openeye Name: 13-amino-13-(2-amino-5,5-dimethyl-3-oxo-cyclohexen-1-yl)tridecanoic acid CAS Name: 13-amino-13-(2-amino-5,5-dimethyl-3-oxo-1-cyclohexenyl)tridecanoic acid IUPAC Name: 13-amino-13-(2-amino-5,5-dimethyl-3-oxocyclohexen-1-yl)tridecanoic acid Traditional Name: 13-amino-13-(2-amino-3-keto-5,5-dimethyl-cyclohexen-1-yl)tridecanoic acid Formula: C21H38N2O3 MolecularWeight: 366.53802

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)N)C(CCCCCCCCCCCC(=O)O)N)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)N)C(CCCCCCCCCCCC(=O)O)N)C

InChI

InChI=1S/C21H38N2O3/c1-21(2)14-16(20(23)18(24)15-21)17(22)12-10-8-6-4-3-5-7-9-11-13-19(25)26/h17H,3-15,22-23H2,1-2H3,(H,25,26)