N,N-bis(phenylmethyl)-3-(2,6,6-trimethyloxan-2-yl)prop-2-yn-1-amine hydrochloride

Systemtic Name: N,N-bis(phenylmethyl)-3-(2,6,6-trimethyloxan-2-yl)prop-2-yn-1-amine hydrochloride Openeye Name: N,N-dibenzyl-3-(2,6,6-trimethyltetrahydropyran-2-yl)prop-2-yn-1-amine hydrochloride CAS Name: N,N-bis(phenylmethyl)-3-(2,6,6-trimethyl-2-oxanyl)-2-propyn-1-amine hydrochloride IUPAC Name: N,N-dibenzyl-3-(2,6,6-trimethyloxan-2-yl)prop-2-yn-1-amine hydrochloride Traditional Name: dibenzyl-[3-(2,6,6-trimethyltetrahydropyran-2-yl)prop-2-ynyl]amine hydrochloride Formula: C25H32ClNO MolecularWeight: 397.98068

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(O1)(C)C#CCN(CC2=CC=CC=C2)CC3=CC=CC=C3)C.Cl

Isomeric SMILES

CC1(CCCC(O1)(C)C#CCN(CC2=CC=CC=C2)CC3=CC=CC=C3)C.Cl

InChI

InChI=1S/C25H31NO.ClH/c1-24(2)16-10-17-25(3,27-24)18-11-19-26(20-22-12-6-4-7-13-22)21-23-14-8-5-9-15-23;/h4-9,12-15H,10,16-17,19-21H2,1-3H3;1H