7-[(4-methoxyphenoxy)methyl]-7-phenyl-4-(phenylmethyl)-1,4-oxazepane hydrochloride

Systemtic Name: 7-[(4-methoxyphenoxy)methyl]-7-phenyl-4-(phenylmethyl)-1,4-oxazepane hydrochloride Openeye Name: 4-benzyl-7-[(4-methoxyphenoxy)methyl]-7-phenyl-1,4-oxazepane hydrochloride CAS Name: 7-[(4-methoxyphenoxy)methyl]-7-phenyl-4-(phenylmethyl)-1,4-oxazepane hydrochloride IUPAC Name: 4-benzyl-7-[(4-methoxyphenoxy)methyl]-7-phenyl-1,4-oxazepane hydrochloride Traditional Name: 4-benzyl-7-[(4-methoxyphenoxy)methyl]-7-phenyl-1,4-oxazepane hydrochloride Formula: C26H30ClNO3 MolecularWeight: 439.9743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2(CCN(CCO2)CC3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

COC1=CC=C(C=C1)OCC2(CCN(CCO2)CC3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H29NO3.ClH/c1-28-24-12-14-25(15-13-24)29-21-26(23-10-6-3-7-11-23)16-17-27(18-19-30-26)20-22-8-4-2-5-9-22;/h2-15H,16-21H2,1H3;1H