4-[[cyclopropyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]methyl]benzamide

Systemtic Name: 4-[[cyclopropyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]methyl]benzamide Openeye Name: 4-[[cyclopropyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]methyl]benzamide CAS Name: 4-[[cyclopropyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]methyl]benzamide IUPAC Name: 4-[[cyclopropyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]methyl]benzamide Traditional Name: 4-[[cyclopropyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]methyl]benzamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)C(=O)N)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)C(=O)N)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C20H21N3O5/c21-20(24)14-3-1-13(2-4-14)9-22(17-5-6-17)10-15-7-18(23(25)26)8-16-11-27-12-28-19(15)16/h1-4,7-8,17H,5-6,9-12H2,(H2,21,24)