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

Systemtic Name: pentyl 2-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]benzoate Openeye Name: pentyl 2-[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]benzoate CAS Name: 2-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]benzoic acid pentyl ester IUPAC Name: pentyl 2-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]benzoate Traditional Name: 2-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]benzoic acid amyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=CC=C1NC=C2C(=O)CC(CC2=O)(C)C

Isomeric SMILES

CCCCCOC(=O)C1=CC=CC=C1NC=C2C(=O)CC(CC2=O)(C)C

InChI

InChI=1S/C21H27NO4/c1-4-5-8-11-26-20(25)15-9-6-7-10-17(15)22-14-16-18(23)12-21(2,3)13-19(16)24/h6-7,9-10,14,22H,4-5,8,11-13H2,1-3H3