1-(5-nitro-1H-indol-2-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one

Systemtic Name: 1-(5-nitro-1H-indol-2-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one Openeye Name: 3-(1-benzyl-4-piperidyl)-1-(5-nitro-1H-indol-2-yl)propan-1-one CAS Name: 1-(5-nitro-1H-indol-2-yl)-3-[1-(phenylmethyl)-4-piperidinyl]-1-propanone IUPAC Name: 3-(1-benzylpiperidin-4-yl)-1-(5-nitro-1H-indol-2-yl)propan-1-one Traditional Name: 3-(1-benzyl-4-piperidyl)-1-(5-nitro-1H-indol-2-yl)propan-1-one Formula: C23H25N3O3 MolecularWeight: 391.4629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)C2=CC3=C(N2)C=CC(=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CCC(=O)C2=CC3=C(N2)C=CC(=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c27-23(22-15-19-14-20(26(28)29)7-8-21(19)24-22)9-6-17-10-12-25(13-11-17)16-18-4-2-1-3-5-18/h1-5,7-8,14-15,17,24H,6,9-13,16H2