N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl]-2-chloranyl-benzamide

Systemtic Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl]-2-chloranyl-benzamide Openeye Name: N-[(1S)-2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl]-2-chloro-benzamide CAS Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl]-2-chlorobenzamide IUPAC Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl]-2-chlorobenzamide Traditional Name: 2-chloro-N-[(1S)-2-keto-1-methyl-2-(piperonylamino)ethyl]benzamide Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H17ClN2O4/c1-11(21-18(23)13-4-2-3-5-14(13)19)17(22)20-9-12-6-7-15-16(8-12)25-10-24-15/h2-8,11H,9-10H2,1H3,(H,20,22)(H,21,23)/t11-/m0/s1