4,5-dimethoxy-2-nitro-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2CCN(C2)CC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2CCN(C2)CC3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23N3O5/c1-27-18-10-16(17(23(25)26)11-19(18)28-2)20(24)21-15-8-9-22(13-15)12-14-6-4-3-5-7-14/h3-7,10-11,15H,8-9,12-13H2,1-2H3,(H,21,24)