ethyl 2-oxidanylidene-5-phenyl-1,3-dihydro-[1,4]diazepino[6,5-b]indole-6-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-5-phenyl-1,3-dihydro-[1,4]diazepino[6,5-b]indole-6-carboxylate Openeye Name: ethyl 2-oxo-5-phenyl-1,3-dihydro-[1,4]diazepino[6,5-b]indole-6-carboxylate CAS Name: 2-oxo-5-phenyl-1,3-dihydro-[1,4]diazepino[6,5-b]indole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-5-phenyl-1,3-dihydro-[1,4]diazepino[6,5-b]indole-6-carboxylate Traditional Name: 2-keto-5-phenyl-1,3-dihydro-[1,4]diazepin[6,5-b]indole-6-carboxylic acid ethyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2C3=C1C(=NCC(=O)N3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2C3=C1C(=NCC(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3/c1-2-26-20(25)23-15-11-7-6-10-14(15)18-19(23)17(21-12-16(24)22-18)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,22,24)