(E)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-pyridin-3-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-pyridin-3-yl-prop-2-en-1-one Openeye Name: (E)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(3-pyridyl)prop-2-en-1-one CAS Name: (E)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(3-pyridinyl)-2-propen-1-one IUPAC Name: (E)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-pyridin-3-ylprop-2-en-1-one Traditional Name: (E)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(3-pyridyl)prop-2-en-1-one Formula: C23H20N2O2 MolecularWeight: 356.4171

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1C(=O)C=CC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2CN1C(=O)/C=C/C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O2/c26-23(13-12-18-7-6-14-24-15-18)25-16-20-10-4-5-11-21(20)27-22(17-25)19-8-2-1-3-9-19/h1-15,22H,16-17H2/b13-12+/t22-/m1/s1