methyl 4-[2-(azepan-1-yl)ethylcarbamoyl]benzoate

Systemtic Name: methyl 4-[2-(azepan-1-yl)ethylcarbamoyl]benzoate Openeye Name: methyl 4-[2-(azepan-1-yl)ethylcarbamoyl]benzoate CAS Name: 4-[[2-(1-azepanyl)ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(azepan-1-yl)ethylcarbamoyl]benzoate Traditional Name: 4-[2-(azepan-1-yl)ethylcarbamoyl]benzoic acid methyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCCN2CCCCCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCCN2CCCCCC2

InChI

InChI=1S/C17H24N2O3/c1-22-17(21)15-8-6-14(7-9-15)16(20)18-10-13-19-11-4-2-3-5-12-19/h6-9H,2-5,10-13H2,1H3,(H,18,20)