[5-chloranyl-2-(3-methylazepan-4-yl)oxy-phenyl] heptanoate

Systemtic Name: [5-chloranyl-2-(3-methylazepan-4-yl)oxy-phenyl] heptanoate Openeye Name: [5-chloro-2-(3-methylazepan-4-yl)oxy-phenyl] heptanoate CAS Name: heptanoic acid [5-chloro-2-[(3-methyl-4-azepanyl)oxy]phenyl] ester IUPAC Name: [5-chloro-2-(3-methylazepan-4-yl)oxyphenyl] heptanoate Traditional Name: enanthic acid [5-chloro-2-(3-methylazepan-4-yl)oxy-phenyl] ester Formula: C20H30ClNO3 MolecularWeight: 367.9101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=C(C=CC(=C1)Cl)OC2CCCNCC2C

Isomeric SMILES

CCCCCCC(=O)OC1=C(C=CC(=C1)Cl)OC2CCCNCC2C

InChI

InChI=1S/C20H30ClNO3/c1-3-4-5-6-9-20(23)25-19-13-16(21)10-11-18(19)24-17-8-7-12-22-14-15(17)2/h10-11,13,15,17,22H,3-9,12,14H2,1-2H3