N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]ethyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-nitro-4-pyrrolidino-benzamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-])C

InChI

InChI=1S/C24H27N5O3/c1-17-15-18(2)28(26-17)21-8-5-19(6-9-21)11-12-25-24(30)20-7-10-22(23(16-20)29(31)32)27-13-3-4-14-27/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,25,30)