1-(4-tert-butylphenyl)sulfonyl-4-pyrrolidin-1-yl-azepane

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-4-pyrrolidin-1-yl-azepane Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-4-pyrrolidin-1-yl-azepane CAS Name: 1-(4-tert-butylphenyl)sulfonyl-4-(1-pyrrolidinyl)azepane IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-4-pyrrolidin-1-ylazepane Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-4-pyrrolidino-azepane Formula: C20H32N2O2S MolecularWeight: 364.54528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC(CC2)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC(CC2)N3CCCC3

InChI

InChI=1S/C20H32N2O2S/c1-20(2,3)17-8-10-19(11-9-17)25(23,24)22-15-6-7-18(12-16-22)21-13-4-5-14-21/h8-11,18H,4-7,12-16H2,1-3H3