2-[4-(decan-3-ylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(decan-3-ylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(1-ethyloctylamino)phenyl]acetic acid CAS Name: 2-[4-(decan-3-ylamino)phenyl]acetic acid IUPAC Name: 2-[4-(decan-3-ylamino)phenyl]acetic acid Traditional Name: 2-[4-(1-ethyloctylamino)phenyl]acetic acid Formula: C18H29NO2 MolecularWeight: 291.42836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29NO2/c1-3-5-6-7-8-9-16(4-2)19-17-12-10-15(11-13-17)14-18(20)21/h10-13,16,19H,3-9,14H2,1-2H3,(H,20,21)