[2-[(2E)-3,7-dimethylocta-2,6-dienoxy]ethanoyl-methyl-amino] 4-acetamidobenzoate

Systemtic Name: [2-[(2E)-3,7-dimethylocta-2,6-dienoxy]ethanoyl-methyl-amino] 4-acetamidobenzoate Openeye Name: [[2-[(2E)-3,7-dimethylocta-2,6-dienoxy]acetyl]-methyl-amino] 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid [[2-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-oxoethyl]-methylamino] ester IUPAC Name: [[2-[(2E)-3,7-dimethylocta-2,6-dienoxy]acetyl]-methylamino] 4-acetamidobenzoate Traditional Name: 4-acetamidobenzoic acid [[2-[(2E)-3,7-dimethylocta-2,6-dienoxy]acetyl]-methyl-amino] ester Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCOCC(=O)N(C)OC(=O)C1=CC=C(C=C1)NC(=O)C)C)C

Isomeric SMILES

CC(=CCC/C(=C/COCC(=O)N(C)OC(=O)C1=CC=C(C=C1)NC(=O)C)/C)C

InChI

InChI=1S/C22H30N2O5/c1-16(2)7-6-8-17(3)13-14-28-15-21(26)24(5)29-22(27)19-9-11-20(12-10-19)23-18(4)25/h7,9-13H,6,8,14-15H2,1-5H3,(H,23,25)/b17-13+