1,5-dimethyl-4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[[4-[(3-nitrobenzyl)amino]benzyl]amino]-2-phenyl-3-pyrazolin-3-one Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCC3=CC=C(C=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCC3=CC=C(C=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H25N5O3/c1-18-24(25(31)29(28(18)2)22-8-4-3-5-9-22)27-16-19-11-13-21(14-12-19)26-17-20-7-6-10-23(15-20)30(32)33/h3-15,26-27H,16-17H2,1-2H3