2-[(5-cycloheptylcyclohexa-1,5-dien-1-yl)oxymethyl]-1-methylsulfonyl-8aH-quinoline

Systemtic Name: 2-[(5-cycloheptylcyclohexa-1,5-dien-1-yl)oxymethyl]-1-methylsulfonyl-8aH-quinoline Openeye Name: 2-[(5-cycloheptylcyclohexa-1,5-dien-1-yl)oxymethyl]-1-methylsulfonyl-8aH-quinoline CAS Name: 2-[(5-cycloheptyl-1-cyclohexa-1,5-dienyl)oxymethyl]-1-methylsulfonyl-8aH-quinoline IUPAC Name: 2-[(5-cycloheptylcyclohexa-1,5-dien-1-yl)oxymethyl]-1-methylsulfonyl-8aH-quinoline Traditional Name: 2-[(5-cycloheptylcyclohexa-1,5-dien-1-yl)oxymethyl]-1-mesyl-8aH-quinoline Formula: C24H31NO3S MolecularWeight: 413.57284

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C2C=CC=CC2=CC=C1COC3=CCCC(=C3)C4CCCCCC4

Isomeric SMILES

CS(=O)(=O)N1C2C=CC=CC2=CC=C1COC3=CCCC(=C3)C4CCCCCC4

InChI

InChI=1S/C24H31NO3S/c1-29(26,27)25-22(16-15-20-11-6-7-14-24(20)25)18-28-23-13-8-12-21(17-23)19-9-4-2-3-5-10-19/h6-7,11,13-17,19,24H,2-5,8-10,12,18H2,1H3