[1-[ethyl(hexan-2-yl)amino]-1-oxidanylidene-2-phosphono-hexan-2-yl]phosphonic acid

Systemtic Name: [1-[ethyl(hexan-2-yl)amino]-1-oxidanylidene-2-phosphono-hexan-2-yl]phosphonic acid Openeye Name: [1-[ethyl(1-methylpentyl)carbamoyl]-1-phosphono-pentyl]phosphonic acid CAS Name: [1-[ethyl(hexan-2-yl)amino]-1-oxo-2-phosphonohexan-2-yl]phosphonic acid IUPAC Name: [1-[ethyl(hexan-2-yl)amino]-1-oxo-2-phosphonohexan-2-yl]phosphonic acid Traditional Name: [1-[ethyl(1-methylpentyl)carbamoyl]-1-phosphono-pentyl]phosphonic acid Formula: C14H31NO7P2 MolecularWeight: 387.345962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)N(CC)C(=O)C(CCCC)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCC(C)N(CC)C(=O)C(CCCC)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H31NO7P2/c1-5-8-10-12(4)15(7-3)13(16)14(11-9-6-2,23(17,18)19)24(20,21)22/h12H,5-11H2,1-4H3,(H2,17,18,19)(H2,20,21,22)