N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]-3-nitro-4-pyrrolidino-benzamide Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1C(CNC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C24H30N4O4/c1-32-23-9-3-2-8-19(23)22(27-14-6-7-15-27)17-25-24(29)18-10-11-20(21(16-18)28(30)31)26-12-4-5-13-26/h2-3,8-11,16,22H,4-7,12-15,17H2,1H3,(H,25,29)