N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-2-methoxy-5-nitro-4-propoxy-benzamide

Systemtic Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-2-methoxy-5-nitro-4-propoxy-benzamide Openeye Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-2-methoxy-5-nitro-4-propoxy-benzamide CAS Name: N-[1-(9-bicyclo[3.3.1]nonanyl)-3-pyrrolidinyl]-2-methoxy-5-nitro-4-propoxybenzamide IUPAC Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-2-methoxy-5-nitro-4-propoxybenzamide Traditional Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-2-methoxy-5-nitro-4-propoxy-benzamide Formula: C24H35N3O5 MolecularWeight: 445.5518

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)OC)C(=O)NC2CCN(C2)C3C4CCCC3CCC4)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)OC)C(=O)NC2CCN(C2)C3C4CCCC3CCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H35N3O5/c1-3-12-32-22-14-21(31-2)19(13-20(22)27(29)30)24(28)25-18-10-11-26(15-18)23-16-6-4-7-17(23)9-5-8-16/h13-14,16-18,23H,3-12,15H2,1-2H3,(H,25,28)