2-[3-ethyl-6-[(4-heptoxyphenyl)methoxy]-3-methoxy-1,2-dihydroinden-2-yl]ethanoate

Systemtic Name: 2-[3-ethyl-6-[(4-heptoxyphenyl)methoxy]-3-methoxy-1,2-dihydroinden-2-yl]ethanoate Openeye Name: 2-[1-ethyl-5-[(4-heptoxyphenyl)methoxy]-1-methoxy-indan-2-yl]acetate CAS Name: 2-[3-ethyl-6-[(4-heptoxyphenyl)methoxy]-3-methoxy-1,2-dihydroinden-2-yl]acetate IUPAC Name: 2-[3-ethyl-6-[(4-heptoxyphenyl)methoxy]-3-methoxy-1,2-dihydroinden-2-yl]acetate Traditional Name: 2-[1-ethyl-5-(4-heptoxybenzyl)oxy-1-methoxy-indan-2-yl]acetate Formula: C28H37O5- MolecularWeight: 453.59038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)COC2=CC3=C(C=C2)C(C(C3)CC(=O)[O-])(CC)OC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)COC2=CC3=C(C=C2)C(C(C3)CC(=O)[O-])(CC)OC

InChI

InChI=1S/C28H38O5/c1-4-6-7-8-9-16-32-24-12-10-21(11-13-24)20-33-25-14-15-26-22(18-25)17-23(19-27(29)30)28(26,5-2)31-3/h10-15,18,23H,4-9,16-17,19-20H2,1-3H3,(H,29,30)/p-1