4-[1-[(2-tert-butylphenyl)amino]-1-oxidanylidene-octan-3-yl]-3-methoxy-benzoic acid

Systemtic Name: 4-[1-[(2-tert-butylphenyl)amino]-1-oxidanylidene-octan-3-yl]-3-methoxy-benzoic acid Openeye Name: 4-[1-[2-(2-tert-butylanilino)-2-oxo-ethyl]hexyl]-3-methoxy-benzoic acid CAS Name: 4-[1-(2-tert-butylanilino)-1-oxooctan-3-yl]-3-methoxybenzoic acid IUPAC Name: 4-[1-(2-tert-butylanilino)-1-oxooctan-3-yl]-3-methoxybenzoic acid Traditional Name: 4-[1-[2-(2-tert-butylanilino)-2-keto-ethyl]hexyl]-3-methoxy-benzoic acid Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=CC=CC=C1C(C)(C)C)C2=C(C=C(C=C2)C(=O)O)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=CC=CC=C1C(C)(C)C)C2=C(C=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C26H35NO4/c1-6-7-8-11-18(20-15-14-19(25(29)30)16-23(20)31-5)17-24(28)27-22-13-10-9-12-21(22)26(2,3)4/h9-10,12-16,18H,6-8,11,17H2,1-5H3,(H,27,28)(H,29,30)