[4-(3-methylazepan-4-yl)oxyphenyl] hexanoate

Systemtic Name: [4-(3-methylazepan-4-yl)oxyphenyl] hexanoate Openeye Name: [4-(3-methylazepan-4-yl)oxyphenyl] hexanoate CAS Name: hexanoic acid [4-[(3-methyl-4-azepanyl)oxy]phenyl] ester IUPAC Name: [4-(3-methylazepan-4-yl)oxyphenyl] hexanoate Traditional Name: hexanoic acid [4-(3-methylazepan-4-yl)oxyphenyl] ester Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)OC2CCCNCC2C

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)OC2CCCNCC2C

InChI

InChI=1S/C19H29NO3/c1-3-4-5-8-19(21)23-17-11-9-16(10-12-17)22-18-7-6-13-20-14-15(18)2/h9-12,15,18,20H,3-8,13-14H2,1-2H3