5-[[5-(butanoylamino)-2-chloranyl-phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[5-(butanoylamino)-2-chloranyl-phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[5-(butanoylamino)-2-chloro-anilino]-5-oxo-pentanoic acid CAS Name: 5-[2-chloro-5-(1-oxobutylamino)anilino]-5-oxopentanoic acid IUPAC Name: 5-[5-(butanoylamino)-2-chloroanilino]-5-oxopentanoic acid Traditional Name: 5-(5-butyramido-2-chloro-anilino)-5-keto-valeric acid Formula: C15H19ClN2O4 MolecularWeight: 326.77536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)CCCC(=O)O

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)CCCC(=O)O

InChI

InChI=1S/C15H19ClN2O4/c1-2-4-13(19)17-10-7-8-11(16)12(9-10)18-14(20)5-3-6-15(21)22/h7-9H,2-6H2,1H3,(H,17,19)(H,18,20)(H,21,22)