(2R)-2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-1-(1H-indol-3-yl)-2-phenyl-ethanone

Systemtic Name: (2R)-2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-1-(1H-indol-3-yl)-2-phenyl-ethanone Openeye Name: (2R)-2-[4-(azepane-1-carbonyl)-1-piperidyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone CAS Name: (2R)-2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-1-(1H-indol-3-yl)-2-phenylethanone IUPAC Name: (2R)-2-[4-(azepane-1-carbonyl)piperidin-1-yl]-1-(1H-indol-3-yl)-2-phenylethanone Traditional Name: (2R)-2-[4-(azepane-1-carbonyl)piperidino]-1-(1H-indol-3-yl)-2-phenyl-ethanone Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(C3=CC=CC=C3)C(=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)[C@H](C3=CC=CC=C3)C(=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C28H33N3O2/c32-27(24-20-29-25-13-7-6-12-23(24)25)26(21-10-4-3-5-11-21)30-18-14-22(15-19-30)28(33)31-16-8-1-2-9-17-31/h3-7,10-13,20,22,26,29H,1-2,8-9,14-19H2/t26-/m1/s1