4-[[2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepin-3-ylidene]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepin-3-ylidene]methyl]benzenecarbonitrile Openeye Name: 4-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepin-3-ylidene)methyl]benzonitrile CAS Name: 4-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepin-3-ylidene)methyl]benzonitrile IUPAC Name: 4-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepin-3-ylidene)methyl]benzonitrile Traditional Name: 4-[(2,4-diketo-1,5-dihydro-1,5-benzodiazepin-3-ylidene)methyl]benzonitrile Formula: C17H11N3O2 MolecularWeight: 289.28814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=CC3=CC=C(C=C3)C#N)C(=O)N2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=CC3=CC=C(C=C3)C#N)C(=O)N2

InChI

InChI=1S/C17H11N3O2/c18-10-12-7-5-11(6-8-12)9-13-16(21)19-14-3-1-2-4-15(14)20-17(13)22/h1-9H,(H,19,21)(H,20,22)