tert-butyl (E)-3-[8-chloranyl-3-methoxy-2,5-bis(oxidanylidene)-1H-1-benzazepin-4-yl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[8-chloranyl-3-methoxy-2,5-bis(oxidanylidene)-1H-1-benzazepin-4-yl]prop-2-enoate Openeye Name: tert-butyl (E)-3-(8-chloro-3-methoxy-2,5-dioxo-1H-1-benzazepin-4-yl)prop-2-enoate CAS Name: (E)-3-(8-chloro-3-methoxy-2,5-dioxo-1H-1-benzazepin-4-yl)-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-(8-chloro-3-methoxy-2,5-dioxo-1H-1-benzazepin-4-yl)prop-2-enoate Traditional Name: (E)-3-(8-chloro-2,5-diketo-3-methoxy-1H-1-benzazepin-4-yl)acrylic acid tert-butyl ester Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=C(C(=O)NC2=C(C1=O)C=CC(=C2)Cl)OC

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=C(C(=O)NC2=C(C1=O)C=CC(=C2)Cl)OC

InChI

InChI=1S/C18H18ClNO5/c1-18(2,3)25-14(21)8-7-12-15(22)11-6-5-10(19)9-13(11)20-17(23)16(12)24-4/h5-9H,1-4H3,(H,20,23)/b8-7+