(4-methyl-8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (4-methyl-8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (8-methyl-4-oxo-tetralin-5-yl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (4-methyl-8-oxo-6,7-dihydro-5H-naphthalen-1-yl) ester IUPAC Name: (4-methyl-8-oxo-6,7-dihydro-5H-naphthalen-1-yl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (4-keto-8-methyl-tetralin-5-yl) ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCC(=O)C2=C(C=C1)OC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C2CCCC(=O)C2=C(C=C1)OC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H23NO5S/c1-15-10-11-20(21-18(15)8-5-9-19(21)24)28-22(25)16-6-4-7-17(14-16)29(26,27)23-12-2-3-13-23/h4,6-7,10-11,14H,2-3,5,8-9,12-13H2,1H3