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

Systemtic Name: 2-[[4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidin-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Openeye Name: 2-[[4-[(2-bromo-5-isopropoxy-phenyl)methyl]-1-piperidyl]methyl]-3,4-dihydro-2H-1,4-benzoxazine CAS Name: 2-[[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]-1-piperidinyl]methyl]-3,4-dihydro-2H-1,4-benzoxazine IUPAC Name: 2-[[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]piperidin-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Traditional Name: 2-[[4-(2-bromo-5-isopropoxy-benzyl)piperidino]methyl]-3,4-dihydro-2H-1,4-benzoxazine Formula: C24H31BrN2O2 MolecularWeight: 459.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CNC4=CC=CC=C4O3

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CNC4=CC=CC=C4O3

InChI

InChI=1S/C24H31BrN2O2/c1-17(2)28-20-7-8-22(25)19(14-20)13-18-9-11-27(12-10-18)16-21-15-26-23-5-3-4-6-24(23)29-21/h3-8,14,17-18,21,26H,9-13,15-16H2,1-2H3