4-(2-phosphonoethanoylamino)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid

Systemtic Name: 4-(2-phosphonoethanoylamino)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Openeye Name: 4-[(2-phosphonoacetyl)amino]-1,2,3,4-tetrahydroquinoline-2-carboxylic acid CAS Name: 4-[(1-oxo-2-phosphonoethyl)amino]-1,2,3,4-tetrahydroquinoline-2-carboxylic acid IUPAC Name: 4-[(2-phosphonoacetyl)amino]-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Traditional Name: 4-[(2-phosphonoacetyl)amino]-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Formula: C12H15N2O6P MolecularWeight: 314.231061

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2NC1C(=O)O)NC(=O)CP(=O)(O)O

Isomeric SMILES

C1C(C2=CC=CC=C2NC1C(=O)O)NC(=O)CP(=O)(O)O

InChI

InChI=1S/C12H15N2O6P/c15-11(6-21(18,19)20)14-9-5-10(12(16)17)13-8-4-2-1-3-7(8)9/h1-4,9-10,13H,5-6H2,(H,14,15)(H,16,17)(H2,18,19,20)