(1S)-3-methyl-1-[4-[(6-methylpyridin-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol

Systemtic Name: (1S)-3-methyl-1-[4-[(6-methylpyridin-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol Openeye Name: (1S)-3-methyl-1-[4-[(6-methyl-2-pyridyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol CAS Name: (1S)-3-methyl-1-[4-[(6-methyl-2-pyridinyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-butanol IUPAC Name: (1S)-3-methyl-1-[4-[(6-methylpyridin-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol Traditional Name: (1S)-3-methyl-1-[4-[(6-methyl-2-pyridyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]butan-1-ol Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCOC3=C(C2)C=C(C=C3)C(CC(C)C)O

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCOC3=C(C2)C=C(C=C3)[C@H](CC(C)C)O

InChI

InChI=1S/C21H28N2O2/c1-15(2)11-20(24)17-7-8-21-18(12-17)13-23(9-10-25-21)14-19-6-4-5-16(3)22-19/h4-8,12,15,20,24H,9-11,13-14H2,1-3H3/t20-/m0/s1