[3-[carboxy(hexyl)amino]-4-methyl-phenyl]-hexyl-carbamic acid

Systemtic Name: [3-[carboxy(hexyl)amino]-4-methyl-phenyl]-hexyl-carbamic acid Openeye Name: [3-[carboxy(hexyl)amino]-4-methyl-phenyl]-hexyl-carbamic acid CAS Name: [3-[carboxy(hexyl)amino]-4-methylphenyl]-hexylcarbamic acid IUPAC Name: [3-[carboxy(hexyl)amino]-4-methylphenyl]-hexylcarbamic acid Traditional Name: [3-[carboxy(hexyl)amino]-4-methyl-phenyl]-hexyl-carbamic acid Formula: C21H34N2O4 MolecularWeight: 378.50566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C1=CC(=C(C=C1)C)N(CCCCCC)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCN(C1=CC(=C(C=C1)C)N(CCCCCC)C(=O)O)C(=O)O

InChI

InChI=1S/C21H34N2O4/c1-4-6-8-10-14-22(20(24)25)18-13-12-17(3)19(16-18)23(21(26)27)15-11-9-7-5-2/h12-13,16H,4-11,14-15H2,1-3H3,(H,24,25)(H,26,27)