[(5R)-7-chloranyl-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl] ethanoate

Systemtic Name: [(5R)-7-chloranyl-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl] ethanoate Openeye Name: [(5R)-7-chloro-1-(p-tolylsulfonyl)-2,3,4,5-tetrahydro-1-benzazepin-5-yl] acetate CAS Name: acetic acid [(5R)-7-chloro-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl] ester IUPAC Name: [(5R)-7-chloro-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl] acetate Traditional Name: acetic acid [(5R)-7-chloro-1-tosyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl] ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C3=C2C=CC(=C3)Cl)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C3=C2C=CC(=C3)Cl)OC(=O)C

InChI

InChI=1S/C19H20ClNO4S/c1-13-5-8-16(9-6-13)26(23,24)21-11-3-4-19(25-14(2)22)17-12-15(20)7-10-18(17)21/h5-10,12,19H,3-4,11H2,1-2H3/t19-/m1/s1