1-methyl-2-[(3-phenylphenoxy)methyl]-3-(piperidin-1-ylmethyl)indole hydrochloride

Systemtic Name: 1-methyl-2-[(3-phenylphenoxy)methyl]-3-(piperidin-1-ylmethyl)indole hydrochloride Openeye Name: 1-methyl-2-[(3-phenylphenoxy)methyl]-3-(1-piperidylmethyl)indole hydrochloride CAS Name: 1-methyl-2-[(3-phenylphenoxy)methyl]-3-(1-piperidinylmethyl)indole hydrochloride IUPAC Name: 1-methyl-2-[(3-phenylphenoxy)methyl]-3-(piperidin-1-ylmethyl)indole hydrochloride Traditional Name: 1-methyl-2-[(3-phenylphenoxy)methyl]-3-(piperidinomethyl)indole hydrochloride Formula: C28H31ClN2O MolecularWeight: 447.01154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1COC3=CC=CC(=C3)C4=CC=CC=C4)CN5CCCCC5.Cl

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1COC3=CC=CC(=C3)C4=CC=CC=C4)CN5CCCCC5.Cl

InChI

InChI=1S/C28H30N2O.ClH/c1-29-27-16-7-6-15-25(27)26(20-30-17-8-3-9-18-30)28(29)21-31-24-14-10-13-23(19-24)22-11-4-2-5-12-22;/h2,4-7,10-16,19H,3,8-9,17-18,20-21H2,1H3;1H