1-adamantyl-[(2R)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 1-adamantyl-[(2R)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: 1-adamantyl-[(1R)-2-(4-fluoro-3-nitro-anilino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[(2R)-1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: 1-adamantyl-[(2R)-1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl]azanium Traditional Name: 1-adamantyl-[(1R)-2-(4-fluoro-3-nitro-anilino)-2-keto-1-methyl-ethyl]ammonium Formula: C19H25FN3O3+ MolecularWeight: 362.418503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])[NH2+]C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])[NH2+]C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H24FN3O3/c1-11(18(24)21-15-2-3-16(20)17(7-15)23(25)26)22-19-8-12-4-13(9-19)6-14(5-12)10-19/h2-3,7,11-14,22H,4-6,8-10H2,1H3,(H,21,24)/p+1/t11-,12?,13?,14?,19?/m1/s1