ethyl 4-[3-(azepan-1-yl)propoxy]benzoate

Systemtic Name: ethyl 4-[3-(azepan-1-yl)propoxy]benzoate Openeye Name: ethyl 4-[3-(azepan-1-yl)propoxy]benzoate CAS Name: 4-[3-(1-azepanyl)propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(azepan-1-yl)propoxy]benzoate Traditional Name: 4-[3-(azepan-1-yl)propoxy]benzoic acid ethyl ester Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCCCN2CCCCCC2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCCCN2CCCCCC2

InChI

InChI=1S/C18H27NO3/c1-2-21-18(20)16-8-10-17(11-9-16)22-15-7-14-19-12-5-3-4-6-13-19/h8-11H,2-7,12-15H2,1H3