(3-methoxyphenyl)methyl-methyl-[(2S)-1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[(2S)-1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (3-methoxyphenyl)methyl-methyl-[(1S)-1-methyl-2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]ammonium CAS Name: (3-methoxyphenyl)methyl-methyl-[(2S)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-methyl-[(2S)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(2-methyl-1H-indol-3-yl)ethyl]-m-anisyl-methyl-ammonium Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)[NH+](C)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)[C@H](C)[NH+](C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H24N2O2/c1-14-20(18-10-5-6-11-19(18)22-14)21(24)15(2)23(3)13-16-8-7-9-17(12-16)25-4/h5-12,15,22H,13H2,1-4H3/p+1/t15-/m0/s1