1,3-benzodioxol-5-yl (2S)-2-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: 1,3-benzodioxol-5-yl (2S)-2-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: 1,3-benzodioxol-5-yl (2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-3-methylbutanoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methyl-butyric acid 1,3-benzodioxol-5-yl ester Formula: C19H17Cl2NO5 MolecularWeight: 410.24798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=CC2=C(C=C1)OCO2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)OC1=CC2=C(C=C1)OCO2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H17Cl2NO5/c1-10(2)17(22-18(23)13-5-3-11(20)7-14(13)21)19(24)27-12-4-6-15-16(8-12)26-9-25-15/h3-8,10,17H,9H2,1-2H3,(H,22,23)/t17-/m0/s1