N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenethyl-4-phenyl-benzamide hydrate hydrochloride

Systemtic Name: N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenethyl-4-phenyl-benzamide hydrate hydrochloride Openeye Name: N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenethyl-4-phenyl-benzamide hydrate hydrochloride CAS Name: N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenethyl-4-phenylbenzamide hydrate hydrochloride IUPAC Name: N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenethyl-4-phenylbenzamide hydrate hydrochloride Traditional Name: N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenethyl-4-phenyl-benzamide hydrate hydrochloride Formula: C29H33ClN2O2 MolecularWeight: 477.03752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C=C(C2)N(CCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5.O.Cl

Isomeric SMILES

CN1C2CCC1C=C(C2)N(CCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5.O.Cl

InChI

InChI=1S/C29H30N2O.ClH.H2O/c1-30-26-16-17-27(30)21-28(20-26)31(19-18-22-8-4-2-5-9-22)29(32)25-14-12-24(13-15-25)23-10-6-3-7-11-23;;/h2-15,20,26-27H,16-19,21H2,1H3;1H;1H2