N-[[3-methyl-7-(1-phenylcyclopropyl)carbonyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[[3-methyl-7-(1-phenylcyclopropyl)carbonyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[[3-methyl-7-(1-phenylcyclopropanecarbonyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[[3-methyl-7-[oxo-(1-phenylcyclopropyl)methyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[[3-methyl-7-(1-phenylcyclopropanecarbonyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[[3-methyl-7-(1-phenylcyclopropanecarbonyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-piperidin-1-ium-1-yl-acetamide Formula: C27H35N4O2+ MolecularWeight: 447.5924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CN(CCC2=C1CNC(=O)C[NH+]3CCCCC3)C(=O)C4(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC=C2CN(CCC2=C1CNC(=O)C[NH+]3CCCCC3)C(=O)C4(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H34N4O2/c1-20-24(17-29-25(32)19-30-13-6-3-7-14-30)23-10-15-31(18-21(23)16-28-20)26(33)27(11-12-27)22-8-4-2-5-9-22/h2,4-5,8-9,16H,3,6-7,10-15,17-19H2,1H3,(H,29,32)/p+1