N-(3,5-dimethoxyphenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(3,5-dimethoxyphenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(3,5-dimethoxyphenyl)-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3,5-dimethoxyphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(3,5-dimethoxyphenyl)-3-nitro-4-pyrrolidino-benzamide Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21N3O5/c1-26-15-10-14(11-16(12-15)27-2)20-19(23)13-5-6-17(18(9-13)22(24)25)21-7-3-4-8-21/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,20,23)