4-(cyclopropylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c23-19(20-11-12-1-6-17-18(9-12)27-8-7-26-17)13-2-5-15(21-14-3-4-14)16(10-13)22(24)25/h1-2,5-6,9-10,14,21H,3-4,7-8,11H2,(H,20,23)