N-[(3-pyrimidin-2-yloxyphenyl)methyl]cycloheptanamine hydrochloride

Systemtic Name: N-[(3-pyrimidin-2-yloxyphenyl)methyl]cycloheptanamine hydrochloride Openeye Name: N-[(3-pyrimidin-2-yloxyphenyl)methyl]cycloheptanamine hydrochloride CAS Name: N-[[3-(2-pyrimidinyloxy)phenyl]methyl]cycloheptanamine hydrochloride IUPAC Name: N-[(3-pyrimidin-2-yloxyphenyl)methyl]cycloheptanamine hydrochloride Traditional Name: cycloheptyl-[3-(2-pyrimidyloxy)benzyl]amine hydrochloride Formula: C18H24ClN3O MolecularWeight: 333.85566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NCC2=CC(=CC=C2)OC3=NC=CC=N3.Cl

Isomeric SMILES

C1CCCC(CC1)NCC2=CC(=CC=C2)OC3=NC=CC=N3.Cl

InChI

InChI=1S/C18H23N3O.ClH/c1-2-4-9-16(8-3-1)21-14-15-7-5-10-17(13-15)22-18-19-11-6-12-20-18;/h5-7,10-13,16,21H,1-4,8-9,14H2;1H