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

Systemtic Name: hexadecyl 4-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]benzoate Openeye Name: hexadecyl 4-[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]benzoate CAS Name: 4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]benzoic acid hexadecyl ester IUPAC Name: hexadecyl 4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]benzoate Traditional Name: 4-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]benzoic acid cetyl ester Formula: C32H49NO4 MolecularWeight: 511.73576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)CC(CC2=O)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)CC(CC2=O)(C)C

InChI

InChI=1S/C32H49NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-37-31(36)26-18-20-27(21-19-26)33-25-28-29(34)23-32(2,3)24-30(28)35/h18-21,25,33H,4-17,22-24H2,1-3H3