ethyl 4-acetamido-3-(azepan-1-ylmethyl)benzoate

Systemtic Name: ethyl 4-acetamido-3-(azepan-1-ylmethyl)benzoate Openeye Name: ethyl 4-acetamido-3-(azepan-1-ylmethyl)benzoate CAS Name: 4-acetamido-3-(1-azepanylmethyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-acetamido-3-(azepan-1-ylmethyl)benzoate Traditional Name: 4-acetamido-3-(azepan-1-ylmethyl)benzoic acid ethyl ester Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C)CN2CCCCCC2

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C)CN2CCCCCC2

InChI

InChI=1S/C18H26N2O3/c1-3-23-18(22)15-8-9-17(19-14(2)21)16(12-15)13-20-10-6-4-5-7-11-20/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,19,21)