(5R)-8-chloranyl-7-methoxy-3,3-di(methyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium

Systemtic Name: (5R)-8-chloranyl-7-methoxy-3,3-di(methyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium Openeye Name: (5R)-8-chloro-7-methoxy-3,3-di(methyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium CAS Name: (5R)-8-chloro-7-methoxy-3,3-di(methyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium IUPAC Name: (5R)-8-chloro-7-methoxy-3,3-di(methyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium Traditional Name: (5R)-8-chloro-7-methoxy-3,3-di(methyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium Formula: C19H23ClNO+ MolecularWeight: 319.822985

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC(=C(C=C2C(C1)C3=CC=CC=C3)OC)Cl)C

Isomeric SMILES

[13CH3][N+]1(CCC2=CC(=C(C=C2[C@H](C1)C3=CC=CC=C3)O[13CH3])Cl)[13CH3]

InChI

InChI=1S/C19H23ClNO/c1-21(2)10-9-15-11-18(20)19(22-3)12-16(15)17(13-21)14-7-5-4-6-8-14/h4-8,11-12,17H,9-10,13H2,1-3H3/q+1/t17-/m1/s1/i1+1,2+1,3+1