2-[4-(2-chloroethyl)phenyl]sulfonyl-3,3,5,5-tetramethyl-1,4-dihydro-2-benzazepine

Systemtic Name: 2-[4-(2-chloroethyl)phenyl]sulfonyl-3,3,5,5-tetramethyl-1,4-dihydro-2-benzazepine Openeye Name: 2-[4-(2-chloroethyl)phenyl]sulfonyl-3,3,5,5-tetramethyl-1,4-dihydro-2-benzazepine CAS Name: 2-[4-(2-chloroethyl)phenyl]sulfonyl-3,3,5,5-tetramethyl-1,4-dihydro-2-benzazepine IUPAC Name: 2-[4-(2-chloroethyl)phenyl]sulfonyl-3,3,5,5-tetramethyl-1,4-dihydro-2-benzazepine Traditional Name: 2-[4-(2-chloroethyl)phenyl]sulfonyl-3,3,5,5-tetramethyl-1,4-dihydro-2-benzazepine Formula: C22H28ClNO2S MolecularWeight: 405.98122

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)CCCl)(C)C)C

Isomeric SMILES

CC1(CC(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)CCCl)(C)C)C

InChI

InChI=1S/C22H28ClNO2S/c1-21(2)16-22(3,4)24(15-18-7-5-6-8-20(18)21)27(25,26)19-11-9-17(10-12-19)13-14-23/h5-12H,13-16H2,1-4H3