(4R,5S)-4-azanyl-8-methoxy-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-ol

Systemtic Name: (4R,5S)-4-azanyl-8-methoxy-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-ol Openeye Name: (4R,5S)-4-amino-8-methoxy-1-(p-tolylsulfonyl)-2,3,4,5-tetrahydro-1-benzazepin-5-ol CAS Name: (4R,5S)-4-amino-8-methoxy-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-ol IUPAC Name: (4R,5S)-4-amino-8-methoxy-1-(4-methylphenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-ol Traditional Name: (4R,5S)-4-amino-8-methoxy-1-tosyl-2,3,4,5-tetrahydro-1-benzazepin-5-ol Formula: C18H22N2O4S MolecularWeight: 362.44328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(C(C3=C2C=C(C=C3)OC)O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[C@H]([C@H](C3=C2C=C(C=C3)OC)O)N

InChI

InChI=1S/C18H22N2O4S/c1-12-3-6-14(7-4-12)25(22,23)20-10-9-16(19)18(21)15-8-5-13(24-2)11-17(15)20/h3-8,11,16,18,21H,9-10,19H2,1-2H3/t16-,18+/m1/s1