N-[(2S)-1-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[(2S)-1-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[(1S)-1-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]-2-methyl-propyl]-3-methyl-benzamide CAS Name: N-[(2S)-1-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[(2S)-1-[2-(1,3-benzodioxole-5-carbonyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: 3-methyl-N-[(1S)-2-methyl-1-[(piperonyloylamino)carbamoyl]propyl]benzamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H23N3O5/c1-12(2)18(22-19(25)14-6-4-5-13(3)9-14)21(27)24-23-20(26)15-7-8-16-17(10-15)29-11-28-16/h4-10,12,18H,11H2,1-3H3,(H,22,25)(H,23,26)(H,24,27)/t18-/m0/s1