[1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl ethanoate

Systemtic Name: [1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl ethanoate Openeye Name: [1-(p-tolylsulfonyl)-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl acetate CAS Name: acetic acid [1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl ester IUPAC Name: [1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl acetate Traditional Name: acetic acid (1-tosyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl)methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C3=CC=CC=C32)COC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C3=CC=CC=C32)COC(=O)C

InChI

InChI=1S/C20H23NO4S/c1-15-9-11-18(12-10-15)26(23,24)21-13-5-6-17(14-25-16(2)22)19-7-3-4-8-20(19)21/h3-4,7-12,17H,5-6,13-14H2,1-2H3