ethyl 4-[(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxo-butanoate CAS Name: 4-[(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]butyric acid ethyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC2=C(C=C1)OC3=C(C=C(C=C3)C)NC2=O

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC2=C(C=C1)OC3=C(C=C(C=C3)C)NC2=O

InChI

InChI=1S/C20H20N2O5/c1-3-26-19(24)9-8-18(23)21-13-5-7-16-14(11-13)20(25)22-15-10-12(2)4-6-17(15)27-16/h4-7,10-11H,3,8-9H2,1-2H3,(H,21,23)(H,22,25)