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

Systemtic Name: 1,5-dimethyl-4-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethylamino]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethylamino]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethylamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethylamino]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[2-[4-[(3-nitrobenzyl)amino]phenyl]ethylamino]-2-phenyl-3-pyrazolin-3-one Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCCC3=CC=C(C=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCCC3=CC=C(C=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H27N5O3/c1-19-25(26(32)30(29(19)2)23-8-4-3-5-9-23)27-16-15-20-11-13-22(14-12-20)28-18-21-7-6-10-24(17-21)31(33)34/h3-14,17,27-28H,15-16,18H2,1-2H3