[(3R)-3,7-dimethyloct-6-enyl] 4-[(4-bromophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [(3R)-3,7-dimethyloct-6-enyl] 4-[(4-bromophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [(3R)-3,7-dimethyloct-6-enyl] 4-(4-bromoanilino)-4-oxo-butanoate CAS Name: 4-(4-bromoanilino)-4-oxobutanoic acid [(3R)-3,7-dimethyloct-6-enyl] ester IUPAC Name: [(3R)-3,7-dimethyloct-6-enyl] 4-(4-bromoanilino)-4-oxobutanoate Traditional Name: 4-(4-bromoanilino)-4-keto-butyric acid [(3R)-3,7-dimethyloct-6-enyl] ester Formula: C20H28BrNO3 MolecularWeight: 410.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CCOC(=O)CCC(=O)NC1=CC=C(C=C1)Br

Isomeric SMILES

C[C@H](CCC=C(C)C)CCOC(=O)CCC(=O)NC1=CC=C(C=C1)Br

InChI

InChI=1S/C20H28BrNO3/c1-15(2)5-4-6-16(3)13-14-25-20(24)12-11-19(23)22-18-9-7-17(21)8-10-18/h5,7-10,16H,4,6,11-14H2,1-3H3,(H,22,23)/t16-/m1/s1