N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-nitrophenyl)butanediamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-nitrophenyl)butanediamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-nitrophenyl)butanediamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-nitrophenyl)butanediamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-nitrophenyl)butanediamide Traditional Name: N'-(4-nitrophenyl)-N-piperonyl-succinamide Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6/c22-17(19-10-12-1-6-15-16(9-12)27-11-26-15)7-8-18(23)20-13-2-4-14(5-3-13)21(24)25/h1-6,9H,7-8,10-11H2,(H,19,22)(H,20,23)