methyl (E)-4-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxidanylidene-but-2-enoate

Systemtic Name: methyl (E)-4-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxidanylidene-but-2-enoate Openeye Name: methyl (E)-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxo-but-2-enoate CAS Name: (E)-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxo-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxobut-2-enoate Traditional Name: (E)-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-keto-but-2-enoic acid methyl ester Formula: C18H14ClNO4 MolecularWeight: 343.76106

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)N1CC2=CC=CC=C2OC3=C1C=C(C=C3)Cl

Isomeric SMILES

COC(=O)/C=C/C(=O)N1CC2=CC=CC=C2OC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C18H14ClNO4/c1-23-18(22)9-8-17(21)20-11-12-4-2-3-5-15(12)24-16-7-6-13(19)10-14(16)20/h2-10H,11H2,1H3/b9-8+