2-[4-[(4-ethylphenyl)sulfonyl-pentyl-amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-6-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[4-[(4-ethylphenyl)sulfonyl-pentyl-amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-6-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-[(4-ethylphenyl)sulfonyl-pentyl-amino]-3-hydroxy-2,2-dimethyl-chroman-6-yl]-N-phenethyl-acetamide CAS Name: 2-[4-[(4-ethylphenyl)sulfonyl-pentylamino]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl]-N-phenethylacetamide IUPAC Name: 2-[4-[(4-ethylphenyl)sulfonyl-pentylamino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl]-N-phenethylacetamide Traditional Name: 2-[4-[amyl-(4-ethylphenyl)sulfonyl-amino]-3-hydroxy-2,2-dimethyl-chroman-6-yl]-N-phenethyl-acetamide Formula: C34H44N2O5S MolecularWeight: 592.78856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1C(C(OC2=C1C=C(C=C2)CC(=O)NCCC3=CC=CC=C3)(C)C)O)S(=O)(=O)C4=CC=C(C=C4)CC

Isomeric SMILES

CCCCCN(C1C(C(OC2=C1C=C(C=C2)CC(=O)NCCC3=CC=CC=C3)(C)C)O)S(=O)(=O)C4=CC=C(C=C4)CC

InChI

InChI=1S/C34H44N2O5S/c1-5-7-11-22-36(42(39,40)28-17-14-25(6-2)15-18-28)32-29-23-27(16-19-30(29)41-34(3,4)33(32)38)24-31(37)35-21-20-26-12-9-8-10-13-26/h8-10,12-19,23,32-33,38H,5-7,11,20-22,24H2,1-4H3,(H,35,37)