ethyl 4-azanyl-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyethanoyl)amino]benzoate

Systemtic Name: ethyl 4-azanyl-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyethanoyl)amino]benzoate Openeye Name: ethyl 4-amino-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyacetyl)amino]benzoate CAS Name: 4-amino-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxy-1-oxoethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyacetyl)amino]benzoate Traditional Name: 4-amino-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyacetyl)amino]benzoic acid ethyl ester Formula: C29H46N2O4 MolecularWeight: 486.68654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)N(CC=C(C)CCC=C(C)C)C1=C(C=CC(=C1)N)C(=O)OCC

Isomeric SMILES

CCCCCCCCOCC(=O)N(C/C=C(/C)\CCC=C(C)C)C1=C(C=CC(=C1)N)C(=O)OCC

InChI

InChI=1S/C29H46N2O4/c1-6-8-9-10-11-12-20-34-22-28(32)31(19-18-24(5)15-13-14-23(3)4)27-21-25(30)16-17-26(27)29(33)35-7-2/h14,16-18,21H,6-13,15,19-20,22,30H2,1-5H3/b24-18-