tert-butyl 2-(6-methyl-5-oxidanylidene-pyrido[3,2-c][1,5]benzodiazepin-11-yl)ethanoate

Systemtic Name: tert-butyl 2-(6-methyl-5-oxidanylidene-pyrido[3,2-c][1,5]benzodiazepin-11-yl)ethanoate Openeye Name: tert-butyl 2-(6-methyl-5-oxo-pyrido[3,2-c][1,5]benzodiazepin-11-yl)acetate CAS Name: 2-(6-methyl-5-oxo-11-pyrido[3,2-c][1,5]benzodiazepinyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(6-methyl-5-oxopyrido[3,2-c][1,5]benzodiazepin-11-yl)acetate Traditional Name: 2-(5-keto-6-methyl-pyrido[3,2-c][1,5]benzodiazepin-11-yl)acetic acid tert-butyl ester Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C2=CC=CC=C2N(C(=O)C3=C1N=CC=C3)C

Isomeric SMILES

CC(C)(C)OC(=O)CN1C2=CC=CC=C2N(C(=O)C3=C1N=CC=C3)C

InChI

InChI=1S/C19H21N3O3/c1-19(2,3)25-16(23)12-22-15-10-6-5-9-14(15)21(4)18(24)13-8-7-11-20-17(13)22/h5-11H,12H2,1-4H3