(2R)-2-(2,2-dimethylpropylideneazaniumyl)-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-(2,2-dimethylpropylideneazaniumyl)-3-(1H-indol-3-yl)propanoate Openeye Name: (2R)-2-(2,2-dimethylpropylideneammonio)-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-(2,2-dimethylpropylideneammonio)-3-(1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-(2,2-dimethylpropylideneazaniumyl)-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-neopentylideneammonio-propionate Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=[NH+]C(CC1=CNC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C=[NH+][C@H](CC1=CNC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C16H20N2O2/c1-16(2,3)10-18-14(15(19)20)8-11-9-17-13-7-5-4-6-12(11)13/h4-7,9-10,14,17H,8H2,1-3H3,(H,19,20)/t14-/m1/s1