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2-[(4-octylphenyl)methylcarbamoylamino]ethanoic acid

2-[(4-octylphenyl)methylcarbamoylamino]ethanoic acid

Systemtic Name:2-[(4-octylphenyl)methylcarbamoylamino]ethanoic acid
Openeye Name:2-[(4-octylphenyl)methylcarbamoylamino]acetic acid
CAS Name:2-[[[(4-octylphenyl)methylamino]-oxomethyl]amino]acetic acid
IUPAC Name:2-[(4-octylphenyl)methylcarbamoylamino]acetic acid
Traditional Name:2-[(4-octylbenzyl)carbamoylamino]acetic acid
Formula: C18H28N2O3
MolecularWeight: 320.42652
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CNC(=O)NCC(=O)O


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CNC(=O)NCC(=O)O


InChI

InChI=1S/C18H28N2O3/c1-2-3-4-5-6-7-8-15-9-11-16(12-10-15)13-19-18(23)20-14-17(21)22/h9-12H,2-8,13-14H2,1H3,(H,21,22)(H2,19,20,23)


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