cyclohexyl-[4-(thiophen-3-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methanol

Systemtic Name: cyclohexyl-[4-(thiophen-3-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methanol Openeye Name: cyclohexyl-[4-(3-thienylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methanol CAS Name: cyclohexyl-[4-(3-thiophenylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methanol IUPAC Name: cyclohexyl-[4-(thiophen-3-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methanol Traditional Name: cyclohexyl-[4-(3-thenyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methanol Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC3=C(C=C2)OCCN(C3)CC4=CSC=C4)O

Isomeric SMILES

C1CCC(CC1)C(C2=CC3=C(C=C2)OCCN(C3)CC4=CSC=C4)O

InChI

InChI=1S/C21H27NO2S/c23-21(17-4-2-1-3-5-17)18-6-7-20-19(12-18)14-22(9-10-24-20)13-16-8-11-25-15-16/h6-8,11-12,15,17,21,23H,1-5,9-10,13-14H2