2-(2-methyl-4-pyrrolidin-2-yl-butyl)-3-phosphono-butanedioic acid

Systemtic Name: 2-(2-methyl-4-pyrrolidin-2-yl-butyl)-3-phosphono-butanedioic acid Openeye Name: 2-(2-methyl-4-pyrrolidin-2-yl-butyl)-3-phosphono-butanedioic acid CAS Name: 2-[2-methyl-4-(2-pyrrolidinyl)butyl]-3-phosphonobutanedioic acid IUPAC Name: 2-(2-methyl-4-pyrrolidin-2-ylbutyl)-3-phosphonobutanedioic acid Traditional Name: 2-(2-methyl-4-pyrrolidin-2-yl-butyl)-3-phosphono-succinic acid Formula: C13H24NO7P MolecularWeight: 337.305921

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1CCCN1)CC(C(C(=O)O)P(=O)(O)O)C(=O)O

Isomeric SMILES

CC(CCC1CCCN1)CC(C(C(=O)O)P(=O)(O)O)C(=O)O

InChI

InChI=1S/C13H24NO7P/c1-8(4-5-9-3-2-6-14-9)7-10(12(15)16)11(13(17)18)22(19,20)21/h8-11,14H,2-7H2,1H3,(H,15,16)(H,17,18)(H2,19,20,21)