5-azanyl-3-methyl-2-(methylamino)-5-oxidanylidene-pentanoic acid; 2-methylcyclohepta-2,6-dien-1-one

Systemtic Name: 5-azanyl-3-methyl-2-(methylamino)-5-oxidanylidene-pentanoic acid; 2-methylcyclohepta-2,6-dien-1-one Openeye Name: 5-amino-3-methyl-2-(methylamino)-5-oxo-pentanoic acid; 2-methylcyclohepta-2,6-dien-1-one CAS Name: 5-amino-3-methyl-2-(methylamino)-5-oxopentanoic acid; 2-methyl-1-cyclohepta-2,6-dienone IUPAC Name: 5-amino-3-methyl-2-(methylamino)-5-oxopentanoic acid; 2-methylcyclohepta-2,6-dien-1-one Traditional Name: 5-amino-5-keto-3-methyl-2-(methylamino)valeric acid; 2-methylcyclohepta-2,6-dien-1-one Formula: C15H24N2O4 MolecularWeight: 296.36206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC=CC1=O.CC(CC(=O)N)C(C(=O)O)NC

Isomeric SMILES

CC1=CCCC=CC1=O.CC(CC(=O)N)C(C(=O)O)NC

InChI

InChI=1S/C8H10O.C7H14N2O3/c1-7-5-3-2-4-6-8(7)9;1-4(3-5(8)10)6(9-2)7(11)12/h4-6H,2-3H2,1H3;4,6,9H,3H2,1-2H3,(H2,8,10)(H,11,12)