azepan-1-yl-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-(2-methyl-5-nitro-phenyl)imino-phenyl-$l^{5}-phosphane

Systemtic Name: azepan-1-yl-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-(2-methyl-5-nitro-phenyl)imino-phenyl-$l^{5}-phosphane Openeye Name: azepan-1-yl-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-(2-methyl-5-nitro-phenyl)imino-phenyl-$l^{5}-phosphane CAS Name: 1-azepanyl-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-(2-methyl-5-nitrophenyl)imino-phenylphosphorane IUPAC Name: azepan-1-yl-(3,5-dimethyl-1-phenylpyrazol-4-yl)-(2-methyl-5-nitrophenyl)imino-phenyl-$l^{5}-phosphane Traditional Name: azepan-1-yl-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-(2-methyl-5-nitro-phenyl)imino-phenyl-phosphorane Formula: C30H34N5O2P MolecularWeight: 527.597021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N=P(C2=CC=CC=C2)(C3=C(N(N=C3C)C4=CC=CC=C4)C)N5CCCCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N=P(C2=CC=CC=C2)(C3=C(N(N=C3C)C4=CC=CC=C4)C)N5CCCCCC5

InChI

InChI=1S/C30H34N5O2P/c1-23-18-19-27(35(36)37)22-29(23)32-38(28-16-10-7-11-17-28,33-20-12-4-5-13-21-33)30-24(2)31-34(25(30)3)26-14-8-6-9-15-26/h6-11,14-19,22H,4-5,12-13,20-21H2,1-3H3