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

Systemtic Name: [4-(3-methylazepan-4-yl)oxyphenyl] butanoate Openeye Name: [4-(3-methylazepan-4-yl)oxyphenyl] butanoate CAS Name: butanoic acid [4-[(3-methyl-4-azepanyl)oxy]phenyl] ester IUPAC Name: [4-(3-methylazepan-4-yl)oxyphenyl] butanoate Traditional Name: butyric acid [4-(3-methylazepan-4-yl)oxyphenyl] ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-3-5-17(19)21-15-9-7-14(8-10-15)20-16-6-4-11-18-12-13(16)2/h7-10,13,16,18H,3-6,11-12H2,1-2H3