4-[[2-chloranyl-1,4-bis(oxidanylidene)-3,8a-dihydro-2H-naphthalen-4a-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[2-chloranyl-1,4-bis(oxidanylidene)-3,8a-dihydro-2H-naphthalen-4a-yl]amino]benzenecarbonitrile Openeye Name: 4-[(2-chloro-1,4-dioxo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]benzonitrile CAS Name: 4-[(2-chloro-1,4-dioxo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]benzonitrile IUPAC Name: 4-[(2-chloro-1,4-dioxo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]benzonitrile Traditional Name: 4-[(2-chloro-1,4-diketo-3,8a-dihydro-2H-naphthalen-4a-yl)amino]benzonitrile Formula: C17H13ClN2O2 MolecularWeight: 312.75032

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2C=CC=CC2(C1=O)NC3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

C1C(C(=O)C2C=CC=CC2(C1=O)NC3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C17H13ClN2O2/c18-14-9-15(21)17(8-2-1-3-13(17)16(14)22)20-12-6-4-11(10-19)5-7-12/h1-8,13-14,20H,9H2