3-[[3-(hexanoylamino)phenyl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[3-(hexanoylamino)phenyl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-(hexanoylamino)anilino]-3-oxo-propanoic acid CAS Name: 3-oxo-3-[3-(1-oxohexylamino)anilino]propanoic acid IUPAC Name: 3-[3-(hexanoylamino)anilino]-3-oxopropanoic acid Traditional Name: 3-[3-(caproylamino)anilino]-3-keto-propionic acid Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=CC(=C1)NC(=O)CC(=O)O

Isomeric SMILES

CCCCCC(=O)NC1=CC=CC(=C1)NC(=O)CC(=O)O

InChI

InChI=1S/C15H20N2O4/c1-2-3-4-8-13(18)16-11-6-5-7-12(9-11)17-14(19)10-15(20)21/h5-7,9H,2-4,8,10H2,1H3,(H,16,18)(H,17,19)(H,20,21)