9-chloranyl-7-phenylmethoxy-5-(4-phenylmethoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-8-ol hydrochloride

Systemtic Name: 9-chloranyl-7-phenylmethoxy-5-(4-phenylmethoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-8-ol hydrochloride Openeye Name: 7-benzyloxy-5-(4-benzyloxyphenyl)-9-chloro-2,3,4,5-tetrahydro-1H-3-benzazepin-8-ol hydrochloride CAS Name: 9-chloro-7-phenylmethoxy-5-(4-phenylmethoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-8-ol hydrochloride IUPAC Name: 9-chloro-7-phenylmethoxy-5-(4-phenylmethoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-8-ol hydrochloride Traditional Name: 7-benzoxy-5-(4-benzoxyphenyl)-9-chloro-2,3,4,5-tetrahydro-1H-3-benzazepin-8-ol hydrochloride Formula: C30H29Cl2NO3 MolecularWeight: 522.46216

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C2=CC(=C(C(=C21)Cl)O)OCC3=CC=CC=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5.Cl

Isomeric SMILES

C1CNCC(C2=CC(=C(C(=C21)Cl)O)OCC3=CC=CC=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5.Cl

InChI

InChI=1S/C30H28ClNO3.ClH/c31-29-25-15-16-32-18-27(23-11-13-24(14-12-23)34-19-21-7-3-1-4-8-21)26(25)17-28(30(29)33)35-20-22-9-5-2-6-10-22;/h1-14,17,27,32-33H,15-16,18-20H2;1H