N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-1,2-dihydroacenaphthylene-5-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-1,2-dihydroacenaphthylene-5-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-1,2-dihydroacenaphthylene-5-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-1,2-dihydroacenaphthylene-5-carboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-1,2-dihydroacenaphthylene-5-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]acenaphthene-5-carboxamide Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)CC(=O)N

InChI

InChI=1S/C20H23N3O2/c21-18(24)12-23-10-8-15(9-11-23)22-20(25)17-7-6-14-5-4-13-2-1-3-16(17)19(13)14/h1-3,6-7,15H,4-5,8-12H2,(H2,21,24)(H,22,25)/p+1