phenyl 3-methyl-2-methylidene-4-(octylamino)-4-oxidanylidene-butanoate

Systemtic Name: phenyl 3-methyl-2-methylidene-4-(octylamino)-4-oxidanylidene-butanoate Openeye Name: phenyl 3-methyl-2-methylene-4-(octylamino)-4-oxo-butanoate CAS Name: 3-methyl-2-methylene-4-(octylamino)-4-oxobutanoic acid phenyl ester IUPAC Name: phenyl 3-methyl-2-methylidene-4-(octylamino)-4-oxobutanoate Traditional Name: 2-[2-keto-1-methyl-2-(octylamino)ethyl]acrylic acid phenyl ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C(C)C(=C)C(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCNC(=O)C(C)C(=C)C(=O)OC1=CC=CC=C1

InChI

InChI=1S/C20H29NO3/c1-4-5-6-7-8-12-15-21-19(22)16(2)17(3)20(23)24-18-13-10-9-11-14-18/h9-11,13-14,16H,3-8,12,15H2,1-2H3,(H,21,22)