4-(4-butan-2-yloxyphenoxy)-3-methyl-azepane

Systemtic Name: 4-(4-butan-2-yloxyphenoxy)-3-methyl-azepane Openeye Name: 3-methyl-4-(4-sec-butoxyphenoxy)azepane CAS Name: 4-(4-butan-2-yloxyphenoxy)-3-methylazepane IUPAC Name: 4-(4-butan-2-yloxyphenoxy)-3-methylazepane Traditional Name: 3-methyl-4-(4-sec-butoxyphenoxy)azepane Formula: C17H27NO2 MolecularWeight: 277.40178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)OC2CCCNCC2C

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)OC2CCCNCC2C

InChI

InChI=1S/C17H27NO2/c1-4-14(3)19-15-7-9-16(10-8-15)20-17-6-5-11-18-12-13(17)2/h7-10,13-14,17-18H,4-6,11-12H2,1-3H3