(E)-1-[7-(3-chlorophenyl)-9-oxidanyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[7-(3-chlorophenyl)-9-oxidanyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-1-[7-(3-chlorophenyl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-thienyl)prop-2-en-1-one CAS Name: (E)-1-[7-(3-chlorophenyl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-1-[7-(3-chlorophenyl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-1-[7-(3-chlorophenyl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-thienyl)prop-2-en-1-one Formula: C22H18ClNO3S MolecularWeight: 411.90122

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C(=O)C=CC3=CC=CS3)C=C(C=C2O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1COC2=C(CN1C(=O)/C=C/C3=CC=CS3)C=C(C=C2O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H18ClNO3S/c23-18-4-1-3-15(12-18)16-11-17-14-24(8-9-27-22(17)20(25)13-16)21(26)7-6-19-5-2-10-28-19/h1-7,10-13,25H,8-9,14H2/b7-6+