[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone

Systemtic Name: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone Openeye Name: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone CAS Name: [2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-[4-(methylamino)-3-nitrophenyl]methanone IUPAC Name: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylamino)-3-nitrophenyl]methanone Traditional Name: [2-(2,5-dimethoxyphenyl)pyrrolidino]-[4-(methylamino)-3-nitro-phenyl]methanone Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N2CCCC2C3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N2CCCC2C3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5/c1-21-16-8-6-13(11-18(16)23(25)26)20(24)22-10-4-5-17(22)15-12-14(27-2)7-9-19(15)28-3/h6-9,11-12,17,21H,4-5,10H2,1-3H3