N-ethyl-N-(pyren-1-ylmethyl)ethanamine hydrochloride

Systemtic Name: N-ethyl-N-(pyren-1-ylmethyl)ethanamine hydrochloride Openeye Name: N-ethyl-N-(pyren-1-ylmethyl)ethanamine hydrochloride CAS Name: N-ethyl-N-(1-pyrenylmethyl)ethanamine hydrochloride IUPAC Name: N-ethyl-N-(pyren-1-ylmethyl)ethanamine hydrochloride Traditional Name: diethyl(pyren-1-ylmethyl)amine hydrochloride Formula: C21H22ClN MolecularWeight: 323.85908

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1.Cl

Isomeric SMILES

CCN(CC)CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1.Cl

InChI

InChI=1S/C21H21N.ClH/c1-3-22(4-2)14-18-11-10-17-9-8-15-6-5-7-16-12-13-19(18)21(17)20(15)16;/h5-13H,3-4,14H2,1-2H3;1H