2,3-bis(4-methylphenyl)pyren-1-amine

Systemtic Name: 2,3-bis(4-methylphenyl)pyren-1-amine Openeye Name: 2,3-bis(p-tolyl)pyren-1-amine CAS Name: 2,3-bis(4-methylphenyl)-1-pyrenamine IUPAC Name: 2,3-bis(4-methylphenyl)pyren-1-amine Traditional Name: [2,3-bis(p-tolyl)pyren-1-yl]amine Formula: C30H23N MolecularWeight: 397.51032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=CC4=CC=CC5=C4C3=C2C=C5)N)C6=CC=C(C=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=CC4=CC=CC5=C4C3=C2C=C5)N)C6=CC=C(C=C6)C

InChI

InChI=1S/C30H23N/c1-18-6-10-22(11-7-18)27-24-16-14-20-4-3-5-21-15-17-25(29(24)26(20)21)30(31)28(27)23-12-8-19(2)9-13-23/h3-17H,31H2,1-2H3