2-[[3-(cyclohexylamino)-3-oxidanylidene-propanoyl]amino]benzoic acid

Systemtic Name: 2-[[3-(cyclohexylamino)-3-oxidanylidene-propanoyl]amino]benzoic acid Openeye Name: 2-[[3-(cyclohexylamino)-3-oxo-propanoyl]amino]benzoic acid CAS Name: 2-[[3-(cyclohexylamino)-1,3-dioxopropyl]amino]benzoic acid IUPAC Name: 2-[[3-(cyclohexylamino)-3-oxopropanoyl]amino]benzoic acid Traditional Name: 2-[[3-(cyclohexylamino)-3-keto-propanoyl]amino]benzoic acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H20N2O4/c19-14(17-11-6-2-1-3-7-11)10-15(20)18-13-9-5-4-8-12(13)16(21)22/h4-5,8-9,11H,1-3,6-7,10H2,(H,17,19)(H,18,20)(H,21,22)