[4-(cyclopropylamino)-3-nitro-phenyl]-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone

Systemtic Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone Openeye Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone CAS Name: [4-(cyclopropylamino)-3-nitrophenyl]-[2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]methanone IUPAC Name: [4-(cyclopropylamino)-3-nitrophenyl]-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone Traditional Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[2-(2,4-dimethoxyphenyl)pyrrolidino]methanone Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2C(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCCN2C(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-])OC

InChI

InChI=1S/C22H25N3O5/c1-29-16-8-9-17(21(13-16)30-2)19-4-3-11-24(19)22(26)14-5-10-18(23-15-6-7-15)20(12-14)25(27)28/h5,8-10,12-13,15,19,23H,3-4,6-7,11H2,1-2H3