7-chloranyl-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: 7-chloranyl-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: 7-chloro-N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: 7-chloro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: 7-chloro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: 7-chloro-N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-piperonylamide Formula: C14H17ClN2O4 MolecularWeight: 312.74878

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC2=C(C(=C1)Cl)OCO2

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=CC2=C(C(=C1)Cl)OCO2

InChI

InChI=1S/C14H17ClN2O4/c1-3-4-16-13(18)8(2)17-14(19)9-5-10(15)12-11(6-9)20-7-21-12/h5-6,8H,3-4,7H2,1-2H3,(H,16,18)(H,17,19)/t8-/m0/s1