4-(azepan-1-yl)-1-(2,4,6-trimethoxyphenyl)butan-1-one hydrochloride

Systemtic Name: 4-(azepan-1-yl)-1-(2,4,6-trimethoxyphenyl)butan-1-one hydrochloride Openeye Name: 4-(azepan-1-yl)-1-(2,4,6-trimethoxyphenyl)butan-1-one hydrochloride CAS Name: 4-(1-azepanyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone hydrochloride IUPAC Name: 4-(azepan-1-yl)-1-(2,4,6-trimethoxyphenyl)butan-1-one hydrochloride Traditional Name: 4-(azepan-1-yl)-1-(2,4,6-trimethoxyphenyl)butan-1-one hydrochloride Formula: C19H30ClNO4 MolecularWeight: 371.8988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCCCC2)OC.Cl

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCCCC2)OC.Cl

InChI

InChI=1S/C19H29NO4.ClH/c1-22-15-13-17(23-2)19(18(14-15)24-3)16(21)9-8-12-20-10-6-4-5-7-11-20;/h13-14H,4-12H2,1-3H3;1H