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

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6/c1-12(13-4-6-17-18(10-13)28-11-27-17)21-19(23)14-3-5-15(20-7-8-26-2)16(9-14)22(24)25/h3-6,9-10,12,20H,7-8,11H2,1-2H3,(H,21,23)