5-(diisocyanomethylidene)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]-4-isocyano-pyrrol-2-one

Systemtic Name: 5-(diisocyanomethylidene)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]-4-isocyano-pyrrol-2-one Openeye Name: 3-[4-[benzyl(ethyl)amino]phenyl]-5-(diisocyanomethylene)-4-isocyano-pyrrol-2-one CAS Name: 5-(diisocyanomethylidene)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]-4-isocyano-2-pyrrolone IUPAC Name: 3-[4-[benzyl(ethyl)amino]phenyl]-5-(diisocyanomethylidene)-4-isocyanopyrrol-2-one Traditional Name: 3-[4-[benzyl(ethyl)amino]phenyl]-5-(diisocyanomethylene)-4-isocyano-3-pyrrolin-2-one Formula: C23H17N5O MolecularWeight: 379.41398

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C3=C(C(=C([N+]#[C-])[N+]#[C-])NC3=O)[N+]#[C-]

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C3=C(C(=C([N+]#[C-])[N+]#[C-])NC3=O)[N+]#[C-]

InChI

InChI=1S/C23H17N5O/c1-5-28(15-16-9-7-6-8-10-16)18-13-11-17(12-14-18)19-20(24-2)21(27-23(19)29)22(25-3)26-4/h6-14H,5,15H2,1H3,(H,27,29)