[4-(1,3,3-trimethyl-6-nonanoyloxy-2H-inden-1-yl)phenyl] nonanoate

Systemtic Name: [4-(1,3,3-trimethyl-6-nonanoyloxy-2H-inden-1-yl)phenyl] nonanoate Openeye Name: [4-(1,3,3-trimethyl-6-nonanoyloxy-indan-1-yl)phenyl] nonanoate CAS Name: nonanoic acid [4-[1,3,3-trimethyl-6-(1-oxononoxy)-2H-inden-1-yl]phenyl] ester IUPAC Name: [4-(1,3,3-trimethyl-6-nonanoyloxy-2H-inden-1-yl)phenyl] nonanoate Traditional Name: pelargonic acid [4-(1,3,3-trimethyl-6-pelargonyloxy-indan-1-yl)phenyl] ester Formula: C36H52O4 MolecularWeight: 548.79568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2(CC(C3=C2C=C(C=C3)OC(=O)CCCCCCCC)(C)C)C

Isomeric SMILES

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2(CC(C3=C2C=C(C=C3)OC(=O)CCCCCCCC)(C)C)C

InChI

InChI=1S/C36H52O4/c1-6-8-10-12-14-16-18-33(37)39-29-22-20-28(21-23-29)36(5)27-35(3,4)31-25-24-30(26-32(31)36)40-34(38)19-17-15-13-11-9-7-2/h20-26H,6-19,27H2,1-5H3