(Z)-N-butyl-4-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxidanylidene-but-2-enamide

Systemtic Name: (Z)-N-butyl-4-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxidanylidene-but-2-enamide Openeye Name: (Z)-N-butyl-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxo-but-2-enamide CAS Name: (Z)-N-butyl-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxo-2-butenamide IUPAC Name: (Z)-N-butyl-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxobut-2-enamide Traditional Name: (Z)-N-butyl-4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-keto-but-2-enamide Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O3/c1-2-3-12-23-20(25)10-11-21(26)24-14-15-6-4-5-7-18(15)27-19-9-8-16(22)13-17(19)24/h4-11,13H,2-3,12,14H2,1H3,(H,23,25)/b11-10-