2-(3-methoxy-3-oxidanylidene-propyl)-3-oxidanylidene-2-(pentylamino)-5-sulfonyl-pentanoic acid

Systemtic Name: 2-(3-methoxy-3-oxidanylidene-propyl)-3-oxidanylidene-2-(pentylamino)-5-sulfonyl-pentanoic acid Openeye Name: 2-(3-methoxy-3-oxo-propyl)-3-oxo-2-(pentylamino)-5-sulfonyl-pentanoic acid CAS Name: 2-(3-methoxy-3-oxopropyl)-3-oxo-2-(pentylamino)-5-sulfonylpentanoic acid IUPAC Name: 2-(3-methoxy-3-oxopropyl)-3-oxo-2-(pentylamino)-5-sulfonylpentanoic acid Traditional Name: 2-(amylamino)-3-keto-2-(3-keto-3-methoxy-propyl)-5-sulfonyl-valeric acid Formula: C14H23NO7S MolecularWeight: 349.39992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(CCC(=O)OC)(C(=O)CC=S(=O)=O)C(=O)O

Isomeric SMILES

CCCCCNC(CCC(=O)OC)(C(=O)CC=S(=O)=O)C(=O)O

InChI

InChI=1S/C14H23NO7S/c1-3-4-5-9-15-14(13(18)19,8-6-12(17)22-2)11(16)7-10-23(20)21/h10,15H,3-9H2,1-2H3,(H,18,19)