N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C23H25N5O4/c1-32-21-6-4-5-17(13-21)22(26-11-2-3-12-26)15-24-23(29)18-14-25-27(16-18)19-7-9-20(10-8-19)28(30)31/h4-10,13-14,16,22H,2-3,11-12,15H2,1H3,(H,24,29)