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2-[hexadecyl(methyl)carbamoyl]benzoic acid

2-[hexadecyl(methyl)carbamoyl]benzoic acid

Systemtic Name:2-[hexadecyl(methyl)carbamoyl]benzoic acid
Openeye Name:2-[hexadecyl(methyl)carbamoyl]benzoic acid
CAS Name:2-[[hexadecyl(methyl)amino]-oxomethyl]benzoic acid
IUPAC Name:2-[hexadecyl(methyl)carbamoyl]benzoic acid
Traditional Name:2-[cetyl(methyl)carbamoyl]benzoic acid
Formula: C25H41NO3
MolecularWeight: 403.59794
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(C)C(=O)C1=CC=CC=C1C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCN(C)C(=O)C1=CC=CC=C1C(=O)O


InChI

InChI=1S/C25H41NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-26(2)24(27)22-19-16-17-20-23(22)25(28)29/h16-17,19-20H,3-15,18,21H2,1-2H3,(H,28,29)


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