4-[(4-carboxy-3-methyl-nonanoyl)amino]benzoic acid

Systemtic Name: 4-[(4-carboxy-3-methyl-nonanoyl)amino]benzoic acid Openeye Name: 4-[(4-carboxy-3-methyl-nonanoyl)amino]benzoic acid CAS Name: 4-[(4-carboxy-3-methyl-1-oxononyl)amino]benzoic acid IUPAC Name: 4-[(4-carboxy-3-methylnonanoyl)amino]benzoic acid Traditional Name: 4-[(4-carboxy-3-methyl-nonanoyl)amino]benzoic acid Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO5/c1-3-4-5-6-15(18(23)24)12(2)11-16(20)19-14-9-7-13(8-10-14)17(21)22/h7-10,12,15H,3-6,11H2,1-2H3,(H,19,20)(H,21,22)(H,23,24)