2-[[(2-nitrophenyl)amino]-phenyl-methyl]-1,3,5-triphenyl-pentane-1,5-dione

Systemtic Name: 2-[[(2-nitrophenyl)amino]-phenyl-methyl]-1,3,5-triphenyl-pentane-1,5-dione Openeye Name: 2-[(2-nitroanilino)-phenyl-methyl]-1,3,5-triphenyl-pentane-1,5-dione CAS Name: 2-[(2-nitroanilino)-phenylmethyl]-1,3,5-triphenylpentane-1,5-dione IUPAC Name: 2-[(2-nitroanilino)-phenylmethyl]-1,3,5-triphenylpentane-1,5-dione Traditional Name: 2-[(2-nitroanilino)-phenyl-methyl]-1,3,5-triphenyl-pentane-1,5-dione Formula: C36H30N2O4 MolecularWeight: 554.6344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C(C(C3=CC=CC=C3)NC4=CC=CC=C4[N+](=O)[O-])C(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C(C(C3=CC=CC=C3)NC4=CC=CC=C4[N+](=O)[O-])C(=O)C5=CC=CC=C5

InChI

InChI=1S/C36H30N2O4/c39-33(27-17-7-2-8-18-27)25-30(26-15-5-1-6-16-26)34(36(40)29-21-11-4-12-22-29)35(28-19-9-3-10-20-28)37-31-23-13-14-24-32(31)38(41)42/h1-24,30,34-35,37H,25H2