[2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-[(1R)-2-methyl-1-phenyl-propyl]azanium

Systemtic Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-[(1R)-2-methyl-1-phenyl-propyl]azanium Openeye Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-ethyl]-[(1R)-2-methyl-1-phenyl-propyl]ammonium CAS Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl]-[(1R)-2-methyl-1-phenylpropyl]ammonium IUPAC Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl]-[(1R)-2-methyl-1-phenylpropyl]azanium Traditional Name: [2-keto-2-(veratrylamino)ethyl]-[(1R)-2-methyl-1-phenyl-propyl]ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)[NH2+]CC(=O)NCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)[C@H](C1=CC=CC=C1)[NH2+]CC(=O)NCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H28N2O3/c1-15(2)21(17-8-6-5-7-9-17)23-14-20(24)22-13-16-10-11-18(25-3)19(12-16)26-4/h5-12,15,21,23H,13-14H2,1-4H3,(H,22,24)/p+1/t21-/m1/s1