[4-[(2R)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]oxy-3-chloranyl-5-methoxy-phenyl]methylazanium

Systemtic Name: [4-[(2R)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]oxy-3-chloranyl-5-methoxy-phenyl]methylazanium Openeye Name: [4-[(1R)-2-(tert-butylamino)-1-methyl-2-oxo-ethoxy]-3-chloro-5-methoxy-phenyl]methylammonium CAS Name: [4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxy-3-chloro-5-methoxyphenyl]methylammonium IUPAC Name: [4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxy-3-chloro-5-methoxyphenyl]methylazanium Traditional Name: [4-[(1R)-2-(tert-butylamino)-2-keto-1-methyl-ethoxy]-3-chloro-5-methoxy-benzyl]ammonium Formula: C15H24ClN2O3+ MolecularWeight: 315.81566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC1=C(C=C(C=C1Cl)C[NH3+])OC

Isomeric SMILES

C[C@H](C(=O)NC(C)(C)C)OC1=C(C=C(C=C1Cl)C[NH3+])OC

InChI

InChI=1S/C15H23ClN2O3/c1-9(14(19)18-15(2,3)4)21-13-11(16)6-10(8-17)7-12(13)20-5/h6-7,9H,8,17H2,1-5H3,(H,18,19)/p+1/t9-/m1/s1