2-[(4-chloranylphenoxy)methyl]-1-(2-piperidin-1-ylethyl)-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]indole

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-1-(2-piperidin-1-ylethyl)-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]indole Openeye Name: 2-[(4-chlorophenoxy)methyl]-1-[2-(1-piperidyl)ethyl]-3-[[4-(1-piperidyl)-1-piperidyl]methyl]indole CAS Name: 2-[(4-chlorophenoxy)methyl]-1-[2-(1-piperidinyl)ethyl]-3-[[4-(1-piperidinyl)-1-piperidinyl]methyl]indole IUPAC Name: 2-[(4-chlorophenoxy)methyl]-1-(2-piperidin-1-ylethyl)-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]indole Traditional Name: 2-[(4-chlorophenoxy)methyl]-1-(2-piperidinoethyl)-3-[(4-piperidinopiperidino)methyl]indole Formula: C33H45ClN4O MolecularWeight: 549.1896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN2C3=CC=CC=C3C(=C2COC4=CC=C(C=C4)Cl)CN5CCC(CC5)N6CCCCC6

Isomeric SMILES

C1CCN(CC1)CCN2C3=CC=CC=C3C(=C2COC4=CC=C(C=C4)Cl)CN5CCC(CC5)N6CCCCC6

InChI

InChI=1S/C33H45ClN4O/c34-27-11-13-29(14-12-27)39-26-33-31(25-36-21-15-28(16-22-36)37-19-7-2-8-20-37)30-9-3-4-10-32(30)38(33)24-23-35-17-5-1-6-18-35/h3-4,9-14,28H,1-2,5-8,15-26H2