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2-[[(Z)-3-oxidanylideneicos-11-enyl]carbamoyl]benzoic acid

2-[[(Z)-3-oxidanylideneicos-11-enyl]carbamoyl]benzoic acid

Systemtic Name:2-[[(Z)-3-oxidanylideneicos-11-enyl]carbamoyl]benzoic acid
Openeye Name:2-[[(Z)-3-oxoicos-11-enyl]carbamoyl]benzoic acid
CAS Name:2-[oxo-[[(Z)-3-oxoeicos-11-enyl]amino]methyl]benzoic acid
IUPAC Name:2-[[(Z)-3-oxoicos-11-enyl]carbamoyl]benzoic acid
Traditional Name:2-[[(Z)-3-ketoeicos-11-enyl]carbamoyl]benzoic acid
Formula: C28H43NO4
MolecularWeight: 457.64532
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)CCNC(=O)C1=CC=CC=C1C(=O)O


Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)CCNC(=O)C1=CC=CC=C1C(=O)O


InChI

InChI=1S/C28H43NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(30)22-23-29-27(31)25-20-17-18-21-26(25)28(32)33/h9-10,17-18,20-21H,2-8,11-16,19,22-23H2,1H3,(H,29,31)(H,32,33)/b10-9-


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