N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-methyl-3-nitro-4-pyrrolidino-N-veratryl-benzamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5/c1-22(14-15-6-9-19(28-2)20(12-15)29-3)21(25)16-7-8-17(18(13-16)24(26)27)23-10-4-5-11-23/h6-9,12-13H,4-5,10-11,14H2,1-3H3