6-chloranyl-8-methoxy-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol

Systemtic Name: 6-chloranyl-8-methoxy-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Openeye Name: 6-chloro-8-methoxy-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol CAS Name: 6-chloro-8-methoxy-3-methyl-9-(phenylthio)-1,2,4,5-tetrahydro-3-benzazepin-7-ol IUPAC Name: 6-chloro-8-methoxy-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Traditional Name: 6-chloro-8-methoxy-3-methyl-9-(phenylthio)-1,2,4,5-tetrahydro-3-benzazepin-7-ol Formula: C18H20ClNO2S MolecularWeight: 349.8749

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(CC1)C(=C(C(=C2SC3=CC=CC=C3)OC)O)Cl

Isomeric SMILES

CN1CCC2=C(CC1)C(=C(C(=C2SC3=CC=CC=C3)OC)O)Cl

InChI

InChI=1S/C18H20ClNO2S/c1-20-10-8-13-14(9-11-20)18(17(22-2)16(21)15(13)19)23-12-6-4-3-5-7-12/h3-7,21H,8-11H2,1-2H3