3-[[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]methyl]-4-methyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 3-[[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]methyl]-4-methyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 3-[[4-[(2-bromo-5-methoxy-phenyl)methyl]-1-piperidyl]methyl]-4-methyl-2,3-dihydro-1,4-benzoxazine CAS Name: 3-[[4-[(2-bromo-5-methoxyphenyl)methyl]-1-piperidinyl]methyl]-4-methyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 3-[[4-[(2-bromo-5-methoxyphenyl)methyl]piperidin-1-yl]methyl]-4-methyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 3-[[4-(2-bromo-5-methoxy-benzyl)piperidino]methyl]-4-methyl-2,3-dihydro-1,4-benzoxazine Formula: C23H29BrN2O2 MolecularWeight: 445.39256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(COC2=CC=CC=C21)CN3CCC(CC3)CC4=C(C=CC(=C4)OC)Br

Isomeric SMILES

CN1C(COC2=CC=CC=C21)CN3CCC(CC3)CC4=C(C=CC(=C4)OC)Br

InChI

InChI=1S/C23H29BrN2O2/c1-25-19(16-28-23-6-4-3-5-22(23)25)15-26-11-9-17(10-12-26)13-18-14-20(27-2)7-8-21(18)24/h3-8,14,17,19H,9-13,15-16H2,1-2H3