1-adamantyl-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]ammonium Formula: C19H25N2O3+ MolecularWeight: 329.4134

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H24N2O3/c22-18(21-15-1-2-16-17(6-15)24-11-23-16)10-20-19-7-12-3-13(8-19)5-14(4-12)9-19/h1-2,6,12-14,20H,3-5,7-11H2,(H,21,22)/p+1