1-adamantyl-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-(2,3-dimethylanilino)-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-(2,3-dimethylanilino)-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-(2,3-dimethylanilino)-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-(2,3-dimethylanilino)-2-keto-ethyl]ammonium Formula: C20H29N2O+ MolecularWeight: 313.45706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C20H28N2O/c1-13-4-3-5-18(14(13)2)22-19(23)12-21-20-9-15-6-16(10-20)8-17(7-15)11-20/h3-5,15-17,21H,6-12H2,1-2H3,(H,22,23)/p+1