2-methyl-1-[2-oxidanylidene-2-(3-oxidanylidene-1,4-diazepan-1-yl)ethyl]indole-3-carbonitrile

Systemtic Name: 2-methyl-1-[2-oxidanylidene-2-(3-oxidanylidene-1,4-diazepan-1-yl)ethyl]indole-3-carbonitrile Openeye Name: 2-methyl-1-[2-oxo-2-(3-oxo-1,4-diazepan-1-yl)ethyl]indole-3-carbonitrile CAS Name: 2-methyl-1-[2-oxo-2-(3-oxo-1,4-diazepan-1-yl)ethyl]-3-indolecarbonitrile IUPAC Name: 2-methyl-1-[2-oxo-2-(3-oxo-1,4-diazepan-1-yl)ethyl]indole-3-carbonitrile Traditional Name: 1-[2-keto-2-(3-keto-1,4-diazepan-1-yl)ethyl]-2-methyl-indole-3-carbonitrile Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC(=O)N3CCCNC(=O)C3)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC(=O)N3CCCNC(=O)C3)C#N

InChI

InChI=1S/C17H18N4O2/c1-12-14(9-18)13-5-2-3-6-15(13)21(12)11-17(23)20-8-4-7-19-16(22)10-20/h2-3,5-6H,4,7-8,10-11H2,1H3,(H,19,22)