5-(1-benzothiophen-2-yl)-2-methyl-benzo[a]anthracene-7,12-dione

Systemtic Name: 5-(1-benzothiophen-2-yl)-2-methyl-benzo[a]anthracene-7,12-dione Openeye Name: 5-(benzothiophen-2-yl)-2-methyl-benzo[a]anthracene-7,12-dione CAS Name: 5-(1-benzothiophen-2-yl)-2-methylbenzo[a]anthracene-7,12-dione IUPAC Name: 5-(1-benzothiophen-2-yl)-2-methylbenzo[a]anthracene-7,12-dione Traditional Name: 5-(benzothiophen-2-yl)-2-methyl-benz[a]anthracene-7,12-quinone Formula: C27H16O2S MolecularWeight: 404.47974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC3=C2C(=O)C4=CC=CC=C4C3=O)C5=CC6=CC=CC=C6S5

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC3=C2C(=O)C4=CC=CC=C4C3=O)C5=CC6=CC=CC=C6S5

InChI

InChI=1S/C27H16O2S/c1-15-10-11-17-20(24-13-16-6-2-5-9-23(16)30-24)14-22-25(21(17)12-15)27(29)19-8-4-3-7-18(19)26(22)28/h2-14H,1H3