4-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]butanoate

Systemtic Name: 4-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]butanoate Openeye Name: 4-[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]butanoate CAS Name: 4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]butanoate IUPAC Name: 4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]butanoate Traditional Name: 4-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]butyrate Formula: C13H18NO4- MolecularWeight: 252.28632

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNCCCC(=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNCCCC(=O)[O-])C(=O)C1)C

InChI

InChI=1S/C13H19NO4/c1-13(2)6-10(15)9(11(16)7-13)8-14-5-3-4-12(17)18/h8,14H,3-7H2,1-2H3,(H,17,18)/p-1