(2R)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(1H-indol-3-yl)propanoate Openeye Name: (2R)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-(1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(1H-indol-3-yl)propionate Formula: C17H17N4O2- MolecularWeight: 309.34248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(CC2=CNC3=CC=CC=C32)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)[O-])C

InChI

InChI=1S/C17H18N4O2/c1-10-7-11(2)20-17(19-10)21-15(16(22)23)8-12-9-18-14-6-4-3-5-13(12)14/h3-7,9,15,18H,8H2,1-2H3,(H,22,23)(H,19,20,21)/p-1/t15-/m1/s1