5-(4-butylsulfonylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carbonitrile

Systemtic Name: 5-(4-butylsulfonylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carbonitrile Openeye Name: 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carbonitrile CAS Name: 5-[(4-butylsulfonylphenyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carbonitrile IUPAC Name: 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carbonitrile Traditional Name: 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carbonitrile Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=CC=C3N2CCC3C#N

Isomeric SMILES

CCCCS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=CC=C3N2CCC3C#N

InChI

InChI=1S/C19H20N2O3S/c1-2-3-12-25(23,24)16-6-4-14(5-7-16)19(22)18-9-8-17-15(13-20)10-11-21(17)18/h4-9,15H,2-3,10-12H2,1H3