tert-butyl 4,6-dimethyl-5-oxidanylidene-3,4-dihydro-1H-azepino[4,3-b]indole-2-carboxylate

Systemtic Name: tert-butyl 4,6-dimethyl-5-oxidanylidene-3,4-dihydro-1H-azepino[4,3-b]indole-2-carboxylate Openeye Name: tert-butyl 4,6-dimethyl-5-oxo-3,4-dihydro-1H-azepino[4,3-b]indole-2-carboxylate CAS Name: 4,6-dimethyl-5-oxo-3,4-dihydro-1H-azepino[4,3-b]indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4,6-dimethyl-5-oxo-3,4-dihydro-1H-azepino[4,3-b]indole-2-carboxylate Traditional Name: 5-keto-4,6-dimethyl-3,4-dihydro-1H-azepin[4,3-b]indole-2-carboxylic acid tert-butyl ester Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=C(C1=O)N(C3=CC=CC=C23)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CN(CC2=C(C1=O)N(C3=CC=CC=C23)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H24N2O3/c1-12-10-21(18(23)24-19(2,3)4)11-14-13-8-6-7-9-15(13)20(5)16(14)17(12)22/h6-9,12H,10-11H2,1-5H3