N-[(3-tert-butylbenzo[b][1]benzoxepin-5-yl)methyl]-N-methyl-prop-2-yn-1-amine hydrochloride

Systemtic Name: N-[(3-tert-butylbenzo[b][1]benzoxepin-5-yl)methyl]-N-methyl-prop-2-yn-1-amine hydrochloride Openeye Name: N-[(3-tert-butylbenzo[b][1]benzoxepin-5-yl)methyl]-N-methyl-prop-2-yn-1-amine hydrochloride CAS Name: N-[(3-tert-butyl-5-benzo[b][1]benzoxepinyl)methyl]-N-methyl-2-propyn-1-amine hydrochloride IUPAC Name: N-[(3-tert-butylbenzo[b][1]benzoxepin-5-yl)methyl]-N-methylprop-2-yn-1-amine hydrochloride Traditional Name: (3-tert-butylbenzo[b][1]benzoxepin-5-yl)methyl-methyl-propargyl-amine hydrochloride Formula: C23H26ClNO MolecularWeight: 367.91164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC3=CC=CC=C3C=C2CN(C)CC#C.Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC3=CC=CC=C3C=C2CN(C)CC#C.Cl

InChI

InChI=1S/C23H25NO.ClH/c1-6-13-24(5)16-18-14-17-9-7-8-10-21(17)25-22-12-11-19(15-20(18)22)23(2,3)4;/h1,7-12,14-15H,13,16H2,2-5H3;1H