N-[1-[[1-(2-nitrophenyl)-3-oxidanylidene-piperidin-4-yl]carbamoyl]cyclohexyl]quinoline-2-carboxamide

Systemtic Name: N-[1-[[1-(2-nitrophenyl)-3-oxidanylidene-piperidin-4-yl]carbamoyl]cyclohexyl]quinoline-2-carboxamide Openeye Name: N-[1-[[1-(2-nitrophenyl)-3-oxo-4-piperidyl]carbamoyl]cyclohexyl]quinoline-2-carboxamide CAS Name: N-[1-[[[1-(2-nitrophenyl)-3-oxo-4-piperidinyl]amino]-oxomethyl]cyclohexyl]-2-quinolinecarboxamide IUPAC Name: N-[1-[[1-(2-nitrophenyl)-3-oxopiperidin-4-yl]carbamoyl]cyclohexyl]quinoline-2-carboxamide Traditional Name: N-[1-[[3-keto-1-(2-nitrophenyl)-4-piperidyl]carbamoyl]cyclohexyl]quinaldamide Formula: C28H29N5O5 MolecularWeight: 515.56036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NC2CCN(CC2=O)C3=CC=CC=C3[N+](=O)[O-])NC(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC(CC1)(C(=O)NC2CCN(CC2=O)C3=CC=CC=C3[N+](=O)[O-])NC(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H29N5O5/c34-25-18-32(23-10-4-5-11-24(23)33(37)38)17-14-21(25)30-27(36)28(15-6-1-7-16-28)31-26(35)22-13-12-19-8-2-3-9-20(19)29-22/h2-5,8-13,21H,1,6-7,14-18H2,(H,30,36)(H,31,35)