N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-pyrrolidino-benzamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-22(14-15-4-7-19-20(12-15)29-11-10-28-19)21(25)16-5-6-17(18(13-16)24(26)27)23-8-2-3-9-23/h4-7,12-13H,2-3,8-11,14H2,1H3