3-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-6-methyl-indole-1-carboxylic acid

Systemtic Name: 3-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-6-methyl-indole-1-carboxylic acid Openeye Name: 3-(2-amino-3-hydroxy-3-oxo-propyl)-6-methyl-indole-1-carboxylic acid CAS Name: 3-(2-amino-3-hydroxy-3-oxopropyl)-6-methyl-1-indolecarboxylic acid IUPAC Name: 3-(2-amino-3-hydroxy-3-oxopropyl)-6-methylindole-1-carboxylic acid Traditional Name: 3-(2-amino-3-hydroxy-3-keto-propyl)-6-methyl-indole-1-carboxylic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CN2C(=O)O)CC(C(=O)O)N

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CN2C(=O)O)CC(C(=O)O)N

InChI

InChI=1S/C13H14N2O4/c1-7-2-3-9-8(5-10(14)12(16)17)6-15(13(18)19)11(9)4-7/h2-4,6,10H,5,14H2,1H3,(H,16,17)(H,18,19)