(4R,7S)-7-azanyl-3-(2-carboxyethyl)-4,5,6,7-tetrahydro-1H-indole-4-carboxylic acid

Systemtic Name: (4R,7S)-7-azanyl-3-(2-carboxyethyl)-4,5,6,7-tetrahydro-1H-indole-4-carboxylic acid Openeye Name: (4R,7S)-7-amino-3-(2-carboxyethyl)-4,5,6,7-tetrahydro-1H-indole-4-carboxylic acid CAS Name: (4R,7S)-7-amino-3-(2-carboxyethyl)-4,5,6,7-tetrahydro-1H-indole-4-carboxylic acid IUPAC Name: (4R,7S)-7-amino-3-(2-carboxyethyl)-4,5,6,7-tetrahydro-1H-indole-4-carboxylic acid Traditional Name: (4R,7S)-7-amino-3-(2-carboxyethyl)-4,5,6,7-tetrahydro-1H-indole-4-carboxylic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1C(=O)O)C(=CN2)CCC(=O)O)N

Isomeric SMILES

C1C[C@@H](C2=C([C@@H]1C(=O)O)C(=CN2)CCC(=O)O)N

InChI

InChI=1S/C12H16N2O4/c13-8-3-2-7(12(17)18)10-6(1-4-9(15)16)5-14-11(8)10/h5,7-8,14H,1-4,13H2,(H,15,16)(H,17,18)/t7-,8+/m1/s1