2-heptyl-2-[2-heptyl-1,3-bis(oxidanylidene)inden-2-yl]sulfanyl-indene-1,3-dione

Systemtic Name: 2-heptyl-2-[2-heptyl-1,3-bis(oxidanylidene)inden-2-yl]sulfanyl-indene-1,3-dione Openeye Name: 2-heptyl-2-(2-heptyl-1,3-dioxo-indan-2-yl)sulfanyl-indane-1,3-dione CAS Name: 2-heptyl-2-[(2-heptyl-1,3-dioxo-2-indenyl)thio]indene-1,3-dione IUPAC Name: 2-heptyl-2-(2-heptyl-1,3-dioxoinden-2-yl)sulfanylindene-1,3-dione Traditional Name: 2-heptyl-2-[(2-heptyl-1,3-diketo-indan-2-yl)thio]indane-1,3-quinone Formula: C32H38O4S MolecularWeight: 518.70672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(C(=O)C2=CC=CC=C2C1=O)SC3(C(=O)C4=CC=CC=C4C3=O)CCCCCCC

Isomeric SMILES

CCCCCCCC1(C(=O)C2=CC=CC=C2C1=O)SC3(C(=O)C4=CC=CC=C4C3=O)CCCCCCC

InChI

InChI=1S/C32H38O4S/c1-3-5-7-9-15-21-31(27(33)23-17-11-12-18-24(23)28(31)34)37-32(22-16-10-8-6-4-2)29(35)25-19-13-14-20-26(25)30(32)36/h11-14,17-20H,3-10,15-16,21-22H2,1-2H3