(3R)-1-[2-[(6-methoxynaphthalen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-[(6-methoxynaphthalen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-[(6-methoxy-2-naphthyl)methyl-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-[(6-methoxy-2-naphthalenyl)methyl-methylamino]-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-keto-2-[(6-methoxy-2-naphthyl)methyl-methyl-amino]ethyl]piperidin-1-ium-3-carboxamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)C[NH+]3CCCC(C3)C(=O)N

Isomeric SMILES

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)C[NH+]3CCC[C@H](C3)C(=O)N

InChI

InChI=1S/C21H27N3O3/c1-23(20(25)14-24-9-3-4-18(13-24)21(22)26)12-15-5-6-17-11-19(27-2)8-7-16(17)10-15/h5-8,10-11,18H,3-4,9,12-14H2,1-2H3,(H2,22,26)/p+1/t18-/m1/s1