[(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-[(3,4-dimethoxyphenyl)methylcarbamoyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-3-methyl-1-(veratrylcarbamoyl)butyl]ammonium Formula: C15H25N2O3+ MolecularWeight: 281.3706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC1=CC(=C(C=C1)OC)OC)[NH3+]

InChI

InChI=1S/C15H24N2O3/c1-10(2)7-12(16)15(18)17-9-11-5-6-13(19-3)14(8-11)20-4/h5-6,8,10,12H,7,9,16H2,1-4H3,(H,17,18)/p+1/t12-/m0/s1