2-[9-[(4-chlorophenyl)methyl]-6-methylsulfinyl-1,2,3,4-tetrahydrocarbazol-1-yl]ethanoate

Systemtic Name: 2-[9-[(4-chlorophenyl)methyl]-6-methylsulfinyl-1,2,3,4-tetrahydrocarbazol-1-yl]ethanoate Openeye Name: 2-[9-[(4-chlorophenyl)methyl]-6-methylsulfinyl-1,2,3,4-tetrahydrocarbazol-1-yl]acetate CAS Name: 2-[9-[(4-chlorophenyl)methyl]-6-methylsulfinyl-1,2,3,4-tetrahydrocarbazol-1-yl]acetate IUPAC Name: 2-[9-[(4-chlorophenyl)methyl]-6-methylsulfinyl-1,2,3,4-tetrahydrocarbazol-1-yl]acetate Traditional Name: 2-[9-(4-chlorobenzyl)-6-methylsulfinyl-1,2,3,4-tetrahydrocarbazol-1-yl]acetate Formula: C22H21ClNO3S- MolecularWeight: 414.92504

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC2=C(C=C1)N(C3=C2CCCC3CC(=O)[O-])CC4=CC=C(C=C4)Cl

Isomeric SMILES

CS(=O)C1=CC2=C(C=C1)N(C3=C2CCCC3CC(=O)[O-])CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClNO3S/c1-28(27)17-9-10-20-19(12-17)18-4-2-3-15(11-21(25)26)22(18)24(20)13-14-5-7-16(23)8-6-14/h5-10,12,15H,2-4,11,13H2,1H3,(H,25,26)/p-1