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2-[(octanoylamino)carbamoyl]benzoic acid

2-[(octanoylamino)carbamoyl]benzoic acid

Systemtic Name:2-[(octanoylamino)carbamoyl]benzoic acid
Openeye Name:2-[(octanoylamino)carbamoyl]benzoic acid
CAS Name:2-[oxo-(1-oxooctylhydrazo)methyl]benzoic acid
IUPAC Name:2-[(octanoylamino)carbamoyl]benzoic acid
Traditional Name:2-[(caprylylamino)carbamoyl]benzoic acid
Formula: C16H22N2O4
MolecularWeight: 306.35688
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NNC(=O)C1=CC=CC=C1C(=O)O


Isomeric SMILES

CCCCCCCC(=O)NNC(=O)C1=CC=CC=C1C(=O)O


InChI

InChI=1S/C16H22N2O4/c1-2-3-4-5-6-11-14(19)17-18-15(20)12-9-7-8-10-13(12)16(21)22/h7-10H,2-6,11H2,1H3,(H,17,19)(H,18,20)(H,21,22)


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