2-(azepan-1-yl)ethyl 2-(4-chloranylphenoxy)ethanoate

Systemtic Name: 2-(azepan-1-yl)ethyl 2-(4-chloranylphenoxy)ethanoate Openeye Name: 2-(azepan-1-yl)ethyl 2-(4-chlorophenoxy)acetate CAS Name: 2-(4-chlorophenoxy)acetic acid 2-(1-azepanyl)ethyl ester IUPAC Name: 2-(azepan-1-yl)ethyl 2-(4-chlorophenoxy)acetate Traditional Name: 2-(4-chlorophenoxy)acetic acid 2-(azepan-1-yl)ethyl ester Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC(=O)COC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCCN(CC1)CCOC(=O)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H22ClNO3/c17-14-5-7-15(8-6-14)21-13-16(19)20-12-11-18-9-3-1-2-4-10-18/h5-8H,1-4,9-13H2