[5,5-dimethyl-8-(3-methyloctan-2-yl)chromeno[4,3-c]pyridin-10-yl] 4-thiomorpholin-4-ylbutanoate

Systemtic Name: [5,5-dimethyl-8-(3-methyloctan-2-yl)chromeno[4,3-c]pyridin-10-yl] 4-thiomorpholin-4-ylbutanoate Openeye Name: [8-(1,2-dimethylheptyl)-5,5-dimethyl-chromeno[4,3-c]pyridin-10-yl] 4-thiomorpholinobutanoate CAS Name: 4-thiomorpholin-4-ylbutanoic acid [5,5-dimethyl-8-(3-methyloctan-2-yl)-10-[1]benzopyrano[4,3-c]pyridinyl] ester IUPAC Name: [5,5-dimethyl-8-(3-methyloctan-2-yl)chromeno[4,3-c]pyridin-10-yl] 4-thiomorpholin-4-ylbutanoate Traditional Name: 4-thiomorpholinobutyric acid [8-(1,2-dimethylheptyl)-5,5-dimethyl-chromeno[4,3-c]pyridin-10-yl] ester Formula: C31H44N2O3S MolecularWeight: 524.75766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C(C)C1=CC2=C(C(=C1)OC(=O)CCCN3CCSCC3)C4=C(C=CN=C4)C(O2)(C)C

Isomeric SMILES

CCCCCC(C)C(C)C1=CC2=C(C(=C1)OC(=O)CCCN3CCSCC3)C4=C(C=CN=C4)C(O2)(C)C

InChI

InChI=1S/C31H44N2O3S/c1-6-7-8-10-22(2)23(3)24-19-27(35-29(34)11-9-14-33-15-17-37-18-16-33)30-25-21-32-13-12-26(25)31(4,5)36-28(30)20-24/h12-13,19-23H,6-11,14-18H2,1-5H3