(2S)-3,6,6-trimethyl-2-(methylamino)-2-phenyl-7,7a-dihydro-5H-1,3-benzoxazol-3-ium-4-one

Systemtic Name: (2S)-3,6,6-trimethyl-2-(methylamino)-2-phenyl-7,7a-dihydro-5H-1,3-benzoxazol-3-ium-4-one Openeye Name: (2S)-3,6,6-trimethyl-2-(methylamino)-2-phenyl-7,7a-dihydro-5H-1,3-benzoxazol-3-ium-4-one CAS Name: (2S)-3,6,6-trimethyl-2-(methylamino)-2-phenyl-7,7a-dihydro-5H-1,3-benzoxazol-3-ium-4-one IUPAC Name: (2S)-3,6,6-trimethyl-2-(methylamino)-2-phenyl-7,7a-dihydro-5H-1,3-benzoxazol-3-ium-4-one Traditional Name: (2S)-3,6,6-trimethyl-2-(methylamino)-2-phenyl-7,7a-dihydro-5H-1,3-benzoxazol-3-ium-4-one Formula: C17H23N2O2+ MolecularWeight: 287.37672

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C(=[N+](C(O2)(C3=CC=CC=C3)NC)C)C(=O)C1)C

Isomeric SMILES

CC1(CC2C(=[N+]([C@](O2)(C3=CC=CC=C3)NC)C)C(=O)C1)C

InChI

InChI=1S/C17H23N2O2/c1-16(2)10-13(20)15-14(11-16)21-17(18-3,19(15)4)12-8-6-5-7-9-12/h5-9,14,18H,10-11H2,1-4H3/q+1/t14?,17-/m0/s1