[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-[(6-methoxynaphthalen-2-yl)methyl]-methyl-azanium

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl]-[(6-methoxynaphthalen-2-yl)methyl]-methyl-azanium Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl]-[(6-methoxy-2-naphthyl)methyl]-methyl-ammonium CAS Name: [2-(1-adamantylamino)-2-oxoethyl]-[(6-methoxy-2-naphthalenyl)methyl]-methylammonium IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl]-[(6-methoxynaphthalen-2-yl)methyl]-methylazanium Traditional Name: [2-(1-adamantylamino)-2-keto-ethyl]-[(6-methoxy-2-naphthyl)methyl]-methyl-ammonium Formula: C25H33N2O2+ MolecularWeight: 393.54172

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)C=C(C=C2)OC)CC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)C=C(C=C2)OC)CC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H32N2O2/c1-27(15-17-3-4-22-11-23(29-2)6-5-21(22)10-17)16-24(28)26-25-12-18-7-19(13-25)9-20(8-18)14-25/h3-6,10-11,18-20H,7-9,12-16H2,1-2H3,(H,26,28)/p+1