[(1S)-1-(3,4-diethoxyphenyl)ethyl]-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: [(1S)-1-(3,4-diethoxyphenyl)ethyl]-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl]-[(1S)-1-(3,4-diethoxyphenyl)ethyl]ammonium CAS Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[(1S)-1-(3,4-diethoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[(1S)-1-(3,4-diethoxyphenyl)ethyl]azanium Traditional Name: [(1R)-2-anilino-2-keto-1-methyl-ethyl]-[(1S)-1-(3,4-diethoxyphenyl)ethyl]ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)[NH2+]C(C)C(=O)NC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)[NH2+][C@H](C)C(=O)NC2=CC=CC=C2)OCC

InChI

InChI=1S/C21H28N2O3/c1-5-25-19-13-12-17(14-20(19)26-6-2)15(3)22-16(4)21(24)23-18-10-8-7-9-11-18/h7-16,22H,5-6H2,1-4H3,(H,23,24)/p+1/t15-,16+/m0/s1