(3E)-3-[[1-(4-nitrophenyl)carbonylindol-3-yl]methylidene]-1-(phenylmethyl)piperidin-4-one

Systemtic Name: (3E)-3-[[1-(4-nitrophenyl)carbonylindol-3-yl]methylidene]-1-(phenylmethyl)piperidin-4-one Openeye Name: (3E)-1-benzyl-3-[[1-(4-nitrobenzoyl)indol-3-yl]methylene]piperidin-4-one CAS Name: (3E)-3-[[1-[(4-nitrophenyl)-oxomethyl]-3-indolyl]methylidene]-1-(phenylmethyl)-4-piperidinone IUPAC Name: (3E)-1-benzyl-3-[[1-(4-nitrobenzoyl)indol-3-yl]methylidene]piperidin-4-one Traditional Name: (3E)-1-benzyl-3-[[1-(4-nitrobenzoyl)indol-3-yl]methylene]-4-piperidone Formula: C28H23N3O4 MolecularWeight: 465.49992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=CC2=CN(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C1=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(C/C(=C\C2=CN(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])/C1=O)CC5=CC=CC=C5

InChI

InChI=1S/C28H23N3O4/c32-27-14-15-29(17-20-6-2-1-3-7-20)18-23(27)16-22-19-30(26-9-5-4-8-25(22)26)28(33)21-10-12-24(13-11-21)31(34)35/h1-13,16,19H,14-15,17-18H2/b23-16+