1-(4-methyl-1,4-diazepan-1-yl)-3-phenyl-isoquinoline hydrochloride

Systemtic Name: 1-(4-methyl-1,4-diazepan-1-yl)-3-phenyl-isoquinoline hydrochloride Openeye Name: 1-(4-methyl-1,4-diazepan-1-yl)-3-phenyl-isoquinoline hydrochloride CAS Name: 1-(4-methyl-1,4-diazepan-1-yl)-3-phenylisoquinoline hydrochloride IUPAC Name: 1-(4-methyl-1,4-diazepan-1-yl)-3-phenylisoquinoline hydrochloride Traditional Name: 1-(4-methyl-1,4-diazepan-1-yl)-3-phenyl-isoquinoline hydrochloride Formula: C21H24ClN3 MolecularWeight: 353.88836

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=CC=C4.Cl

Isomeric SMILES

CN1CCCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=CC=C4.Cl

InChI

InChI=1S/C21H23N3.ClH/c1-23-12-7-13-24(15-14-23)21-19-11-6-5-10-18(19)16-20(22-21)17-8-3-2-4-9-17;/h2-6,8-11,16H,7,12-15H2,1H3;1H