[4,4-dimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c]chromen-9-yl] 4-piperidin-1-ylbutanoate

Systemtic Name: [4,4-dimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c]chromen-9-yl] 4-piperidin-1-ylbutanoate Openeye Name: [7-(1,2-dimethylheptyl)-4,4-dimethyl-1,2-dihydrothieno[2,3-c]chromen-9-yl] 4-(1-piperidyl)butanoate CAS Name: 4-(1-piperidinyl)butanoic acid [4,4-dimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c][1]benzopyran-9-yl] ester IUPAC Name: [4,4-dimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c]chromen-9-yl] 4-piperidin-1-ylbutanoate Traditional Name: 4-piperidinobutyric acid [7-(1,2-dimethylheptyl)-4,4-dimethyl-1,2-dihydrothieno[2,3-c]chromen-9-yl] ester Formula: C31H47NO3S MolecularWeight: 513.77478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C(C)C1=CC2=C(C3=C(C(O2)(C)C)SCC3)C(=C1)OC(=O)CCCN4CCCCC4

Isomeric SMILES

CCCCCC(C)C(C)C1=CC2=C(C3=C(C(O2)(C)C)SCC3)C(=C1)OC(=O)CCCN4CCCCC4

InChI

InChI=1S/C31H47NO3S/c1-6-7-9-13-22(2)23(3)24-20-26(34-28(33)14-12-18-32-16-10-8-11-17-32)29-25-15-19-36-30(25)31(4,5)35-27(29)21-24/h20-23H,6-19H2,1-5H3