N-[3-chloranyl-4-(2-methylpropanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-chloranyl-4-(2-methylpropanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-chloro-4-(2-methylpropanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-chloro-4-[(2-methyl-1-oxopropyl)amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-chloro-4-(2-methylpropanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-chloro-4-(isobutyrylamino)phenyl]-piperonylamide Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)Cl

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)Cl

InChI

InChI=1S/C18H17ClN2O4/c1-10(2)17(22)21-14-5-4-12(8-13(14)19)20-18(23)11-3-6-15-16(7-11)25-9-24-15/h3-8,10H,9H2,1-2H3,(H,20,23)(H,21,22)