N-[1-(4-phenoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride

Systemtic Name: N-[1-(4-phenoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride Openeye Name: N-[1-(4-phenoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride CAS Name: N-[1-(4-phenoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride IUPAC Name: N-[1-(4-phenoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride Traditional Name: 1-(4-phenoxyphenyl)ethyl-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine hydrochloride Formula: C20H25ClN2O MolecularWeight: 344.8783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC2=CC=CC=C2)NC3=NCCCCC3.Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)OC2=CC=CC=C2)NC3=NCCCCC3.Cl

InChI

InChI=1S/C20H24N2O.ClH/c1-16(22-20-10-6-3-7-15-21-20)17-11-13-19(14-12-17)23-18-8-4-2-5-9-18;/h2,4-5,8-9,11-14,16H,3,6-7,10,15H2,1H3,(H,21,22);1H