1,5-dimethyl-4-[(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[(5-nitro-2-pyrrolidin-1-yl-phenyl)methyleneamino]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[5-nitro-2-(1-pyrrolidinyl)phenyl]methylideneamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[(5-nitro-2-pyrrolidin-1-ylphenyl)methylideneamino]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[(5-nitro-2-pyrrolidino-benzylidene)amino]-2-phenyl-3-pyrazolin-3-one Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C22H23N5O3/c1-16-21(22(28)26(24(16)2)18-8-4-3-5-9-18)23-15-17-14-19(27(29)30)10-11-20(17)25-12-6-7-13-25/h3-5,8-11,14-15H,6-7,12-13H2,1-2H3