4-methyl-3-(octylamino)benzoic acid

Systemtic Name: 4-methyl-3-(octylamino)benzoic acid Openeye Name: 4-methyl-3-(octylamino)benzoic acid CAS Name: 4-methyl-3-(octylamino)benzoic acid IUPAC Name: 4-methyl-3-(octylamino)benzoic acid Traditional Name: 4-methyl-3-(octylamino)benzoic acid Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C(C=CC(=C1)C(=O)O)C

Isomeric SMILES

CCCCCCCCNC1=C(C=CC(=C1)C(=O)O)C

InChI

InChI=1S/C16H25NO2/c1-3-4-5-6-7-8-11-17-15-12-14(16(18)19)10-9-13(15)2/h9-10,12,17H,3-8,11H2,1-2H3,(H,18,19)