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

Systemtic Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3-methoxy-benzamide Openeye Name: N-[(1S)-2-(1,3-benzodioxol-5-ylmethylamino)-1-(hydroxymethyl)-2-oxo-ethyl]-3-methoxy-benzamide CAS Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-3-methoxybenzamide IUPAC Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-3-methoxybenzamide Traditional Name: N-[(1S)-2-keto-1-methylol-2-(piperonylamino)ethyl]-3-methoxy-benzamide Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(CO)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N[C@@H](CO)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H20N2O6/c1-25-14-4-2-3-13(8-14)18(23)21-15(10-22)19(24)20-9-12-5-6-16-17(7-12)27-11-26-16/h2-8,15,22H,9-11H2,1H3,(H,20,24)(H,21,23)/t15-/m0/s1