N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-ethoxy-4-methoxy-2-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-ethoxy-4-methoxy-2-nitro-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-ethoxy-4-methoxy-2-nitro-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-ethoxy-4-methoxy-2-nitrobenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-ethoxy-4-methoxy-2-nitrobenzamide Traditional Name: 5-ethoxy-N-homopiperonyl-4-methoxy-2-nitro-benzamide Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NCCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NCCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20N2O7/c1-3-26-18-9-13(14(21(23)24)10-16(18)25-2)19(22)20-7-6-12-4-5-15-17(8-12)28-11-27-15/h4-5,8-10H,3,6-7,11H2,1-2H3,(H,20,22)