[1-[1-(phenylmethyl)piperidin-3-yl]indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-[1-(phenylmethyl)piperidin-3-yl]indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(1-benzyl-3-piperidyl)indol-5-yl]-(4-isopropylpiperazin-1-yl)methanone CAS Name: [1-[1-(phenylmethyl)-3-piperidinyl]-5-indolyl]-(4-propan-2-yl-1-piperazinyl)methanone IUPAC Name: [1-(1-benzylpiperidin-3-yl)indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone Traditional Name: [1-(1-benzyl-3-piperidyl)indol-5-yl]-(4-isopropylpiperazino)methanone Formula: C28H36N4O MolecularWeight: 444.61164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N(C=C3)C4CCCN(C4)CC5=CC=CC=C5

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N(C=C3)C4CCCN(C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H36N4O/c1-22(2)30-15-17-31(18-16-30)28(33)25-10-11-27-24(19-25)12-14-32(27)26-9-6-13-29(21-26)20-23-7-4-3-5-8-23/h3-5,7-8,10-12,14,19,22,26H,6,9,13,15-18,20-21H2,1-2H3