1-[2-[(6-methoxynaphthalen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(6-methoxynaphthalen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[(6-methoxy-2-naphthyl)methyl-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[(6-methoxy-2-naphthalenyl)methyl-methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[(6-methoxy-2-naphthyl)methyl-methyl-amino]ethyl]piperidin-1-ium-4-carboxamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H27N3O3/c1-23(20(25)14-24-9-7-16(8-10-24)21(22)26)13-15-3-4-18-12-19(27-2)6-5-17(18)11-15/h3-6,11-12,16H,7-10,13-14H2,1-2H3,(H2,22,26)/p+1