N-(3-methylphenyl)-N-[4-(4-nitrophenyl)phenyl]pyren-1-amine

Systemtic Name: N-(3-methylphenyl)-N-[4-(4-nitrophenyl)phenyl]pyren-1-amine Openeye Name: N-(m-tolyl)-N-[4-(4-nitrophenyl)phenyl]pyren-1-amine CAS Name: N-(3-methylphenyl)-N-[4-(4-nitrophenyl)phenyl]-1-pyrenamine IUPAC Name: N-(3-methylphenyl)-N-[4-(4-nitrophenyl)phenyl]pyren-1-amine Traditional Name: m-tolyl-[4-(4-nitrophenyl)phenyl]-pyren-1-yl-amine Formula: C35H24N2O2 MolecularWeight: 504.57726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4

InChI

InChI=1S/C35H24N2O2/c1-23-4-2-7-31(22-23)36(29-16-10-24(11-17-29)25-12-18-30(19-13-25)37(38)39)33-21-15-28-9-8-26-5-3-6-27-14-20-32(33)35(28)34(26)27/h2-22H,1H3