3-methyl-1-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol

Systemtic Name: 3-methyl-1-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol Openeye Name: 3-methyl-1-[4-(2-thienylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol CAS Name: 3-methyl-1-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-butanol IUPAC Name: 3-methyl-1-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol Traditional Name: 3-methyl-1-[4-(2-thenyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol Formula: C19H25NO2S MolecularWeight: 331.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC2=C(C=C1)OCCN(C2)CC3=CC=CS3)O

Isomeric SMILES

CC(C)CC(C1=CC2=C(C=C1)OCCN(C2)CC3=CC=CS3)O

InChI

InChI=1S/C19H25NO2S/c1-14(2)10-18(21)15-5-6-19-16(11-15)12-20(7-8-22-19)13-17-4-3-9-23-17/h3-6,9,11,14,18,21H,7-8,10,12-13H2,1-2H3