4-[(1R,6R)-7-(4-cyanophenyl)-3,5-dimethyl-2,4-bis(oxidanylidene)-8-oxa-3,5-diazabicyclo[4.2.0]octan-7-yl]benzenecarbonitrile

Systemtic Name: 4-[(1R,6R)-7-(4-cyanophenyl)-3,5-dimethyl-2,4-bis(oxidanylidene)-8-oxa-3,5-diazabicyclo[4.2.0]octan-7-yl]benzenecarbonitrile Openeye Name: 4-[(1R,6R)-7-(4-cyanophenyl)-3,5-dimethyl-2,4-dioxo-8-oxa-3,5-diazabicyclo[4.2.0]octan-7-yl]benzonitrile CAS Name: 4-[(1R,6R)-7-(4-cyanophenyl)-3,5-dimethyl-2,4-dioxo-8-oxa-3,5-diazabicyclo[4.2.0]octan-7-yl]benzonitrile IUPAC Name: 4-[(1R,6R)-7-(4-cyanophenyl)-3,5-dimethyl-2,4-dioxo-8-oxa-3,5-diazabicyclo[4.2.0]octan-7-yl]benzonitrile Traditional Name: 4-[(1R,6R)-7-(4-cyanophenyl)-2,4-diketo-3,5-dimethyl-8-oxa-3,5-diazabicyclo[4.2.0]octan-7-yl]benzonitrile Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2C(C(=O)N(C1=O)C)OC2(C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN1[C@@H]2[C@H](C(=O)N(C1=O)C)OC2(C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H16N4O3/c1-24-18-17(19(26)25(2)20(24)27)28-21(18,15-7-3-13(11-22)4-8-15)16-9-5-14(12-23)6-10-16/h3-10,17-18H,1-2H3/t17-,18-/m1/s1