2-azanyl-5-[4-(carboxymethyloxy)-5-nitro-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[4-(carboxymethyloxy)-5-nitro-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[4-(carboxymethyloxy)-5-nitro-indolin-1-yl]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[4-(carboxymethyloxy)-5-nitro-2,3-dihydroindol-1-yl]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[4-(carboxymethyloxy)-5-nitro-2,3-dihydroindol-1-yl]-5-oxopentanoic acid Traditional Name: 2-amino-5-[4-(carboxymethyloxy)-5-nitro-indolin-1-yl]-5-keto-valeric acid Formula: C15H17N3O8 MolecularWeight: 367.31078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C(=C(C=C2)[N+](=O)[O-])OCC(=O)O)C(=O)CCC(C(=O)O)N

Isomeric SMILES

C1CN(C2=C1C(=C(C=C2)[N+](=O)[O-])OCC(=O)O)C(=O)CCC(C(=O)O)N

InChI

InChI=1S/C15H17N3O8/c16-9(15(22)23)1-4-12(19)17-6-5-8-10(17)2-3-11(18(24)25)14(8)26-7-13(20)21/h2-3,9H,1,4-7,16H2,(H,20,21)(H,22,23)