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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23ClN2O3/c1-9(2)8-18-15(19)10(3)21-14-12(16)5-11(7-17)6-13(14)20-4/h5-6,9-10H,7-8,17H2,1-4H3,(H,18,19)/p+1/t10-/m1/s1