6-chloranyl-3-methyl-9-(2-pyrazol-1-ylethoxy)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride

Systemtic Name: 6-chloranyl-3-methyl-9-(2-pyrazol-1-ylethoxy)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride Openeye Name: 6-chloro-3-methyl-9-(2-pyrazol-1-ylethoxy)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride CAS Name: 6-chloro-3-methyl-9-[2-(1-pyrazolyl)ethoxy]-1,2,4,5-tetrahydro-3-benzazepine hydrochloride IUPAC Name: 6-chloro-3-methyl-9-(2-pyrazol-1-ylethoxy)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride Traditional Name: 6-chloro-3-methyl-9-(2-pyrazol-1-ylethoxy)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride Formula: C16H21Cl2N3O MolecularWeight: 342.26344

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C=CC(=C2CC1)Cl)OCCN3C=CC=N3.Cl

Isomeric SMILES

CN1CCC2=C(C=CC(=C2CC1)Cl)OCCN3C=CC=N3.Cl

InChI

InChI=1S/C16H20ClN3O.ClH/c1-19-9-5-13-14(6-10-19)16(4-3-15(13)17)21-12-11-20-8-2-7-18-20;/h2-4,7-8H,5-6,9-12H2,1H3;1H