2-methyl-4-(7-methylphenanthren-4-yl)pyrene

Systemtic Name: 2-methyl-4-(7-methylphenanthren-4-yl)pyrene Openeye Name: 2-methyl-4-(7-methyl-4-phenanthryl)pyrene CAS Name: 2-methyl-4-(7-methyl-4-phenanthrenyl)pyrene IUPAC Name: 2-methyl-4-(7-methylphenanthren-4-yl)pyrene Traditional Name: 2-methyl-4-(7-methyl-4-phenanthryl)pyrene Formula: C32H22 MolecularWeight: 406.51708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C3=C(C=CC=C3C4=CC5=CC=CC6=C5C7=C4C=C(C=C7C=C6)C)C=C2

Isomeric SMILES

CC1=CC2=C(C=C1)C3=C(C=CC=C3C4=CC5=CC=CC6=C5C7=C4C=C(C=C7C=C6)C)C=C2

InChI

InChI=1S/C32H22/c1-19-9-14-26-23(15-19)12-10-22-6-4-8-27(31(22)26)28-18-24-7-3-5-21-11-13-25-16-20(2)17-29(28)32(25)30(21)24/h3-18H,1-2H3