N-[4-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-2-chloranyl-phenyl]ethanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-2-chloranyl-phenyl]ethanamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-2-chloro-phenyl]acetamide CAS Name: N-[4-[[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]amino]-2-chlorophenyl]acetamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-2-chlorophenyl]acetamide Traditional Name: N-[2-chloro-4-(piperonylcarbamoylamino)phenyl]acetamide Formula: C17H16ClN3O4 MolecularWeight: 361.77964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)NCC2=CC3=C(C=C2)OCO3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)NCC2=CC3=C(C=C2)OCO3)Cl

InChI

InChI=1S/C17H16ClN3O4/c1-10(22)20-14-4-3-12(7-13(14)18)21-17(23)19-8-11-2-5-15-16(6-11)25-9-24-15/h2-7H,8-9H2,1H3,(H,20,22)(H2,19,21,23)