1-[(E)-2-[4-[(E)-1-pyren-1-ylprop-1-en-2-yl]phenyl]prop-1-enyl]pyrene

Systemtic Name: 1-[(E)-2-[4-[(E)-1-pyren-1-ylprop-1-en-2-yl]phenyl]prop-1-enyl]pyrene Openeye Name: 1-[(E)-2-[4-[(E)-1-methyl-2-pyren-1-yl-vinyl]phenyl]prop-1-enyl]pyrene CAS Name: 1-[(E)-2-[4-[(E)-1-(1-pyrenyl)prop-1-en-2-yl]phenyl]prop-1-enyl]pyrene IUPAC Name: 1-[(E)-2-[4-[(E)-1-pyren-1-ylprop-1-en-2-yl]phenyl]prop-1-enyl]pyrene Traditional Name: 1-[(E)-2-[4-[(E)-1-methyl-2-pyren-1-yl-vinyl]phenyl]prop-1-enyl]pyrene Formula: C44H30 MolecularWeight: 558.709

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1)C5=CC=C(C=C5)C(=CC6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6)C

Isomeric SMILES

C/C(=C\C1=C2C3=C(C=C1)C=CC4=C3C(=CC=C4)C=C2)/C5=CC=C(C=C5)/C(=C/C6=C7C8=C(C=C6)C=CC9=C8C(=CC=C9)C=C7)/C

InChI

InChI=1S/C44H30/c1-27(25-37-19-17-35-15-13-31-5-3-7-33-21-23-39(37)43(35)41(31)33)29-9-11-30(12-10-29)28(2)26-38-20-18-36-16-14-32-6-4-8-34-22-24-40(38)44(36)42(32)34/h3-26H,1-2H3/b27-25+,28-26+