(2S)-2-[2-(1,3-benzodioxol-5-yl)ethanoylamino]-3-methyl-butanamide

Systemtic Name: (2S)-2-[2-(1,3-benzodioxol-5-yl)ethanoylamino]-3-methyl-butanamide Openeye Name: (2S)-2-[[2-(1,3-benzodioxol-5-yl)acetyl]amino]-3-methyl-butanamide CAS Name: (2S)-2-[[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]amino]-3-methylbutanamide IUPAC Name: (2S)-2-[[2-(1,3-benzodioxol-5-yl)acetyl]amino]-3-methylbutanamide Traditional Name: (2S)-2-[[2-(1,3-benzodioxol-5-yl)acetyl]amino]-3-methyl-butyramide Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N)NC(=O)CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)[C@@H](C(=O)N)NC(=O)CC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H18N2O4/c1-8(2)13(14(15)18)16-12(17)6-9-3-4-10-11(5-9)20-7-19-10/h3-5,8,13H,6-7H2,1-2H3,(H2,15,18)(H,16,17)/t13-/m0/s1