N-(5,5-dimethoxy-2-pyrrolidin-1-yl-cycloheptyl)-4-nitro-N-propyl-benzamide

Systemtic Name: N-(5,5-dimethoxy-2-pyrrolidin-1-yl-cycloheptyl)-4-nitro-N-propyl-benzamide Openeye Name: N-(5,5-dimethoxy-2-pyrrolidin-1-yl-cycloheptyl)-4-nitro-N-propyl-benzamide CAS Name: N-[5,5-dimethoxy-2-(1-pyrrolidinyl)cycloheptyl]-4-nitro-N-propylbenzamide IUPAC Name: N-(5,5-dimethoxy-2-pyrrolidin-1-ylcycloheptyl)-4-nitro-N-propylbenzamide Traditional Name: N-(5,5-dimethoxy-2-pyrrolidino-cycloheptyl)-4-nitro-N-propyl-benzamide Formula: C23H35N3O5 MolecularWeight: 433.5411

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCC(CCC1N2CCCC2)(OC)OC)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(C1CCC(CCC1N2CCCC2)(OC)OC)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H35N3O5/c1-4-15-25(22(27)18-7-9-19(10-8-18)26(28)29)21-12-14-23(30-2,31-3)13-11-20(21)24-16-5-6-17-24/h7-10,20-21H,4-6,11-17H2,1-3H3