2-[4-(1-butyl-2,2,4-trimethyl-quinolin-6-yl)-3-cyano-5-oxidanylidene-1-prop-2-enyl-pyrrol-2-ylidene]propanedinitrile

Systemtic Name: 2-[4-(1-butyl-2,2,4-trimethyl-quinolin-6-yl)-3-cyano-5-oxidanylidene-1-prop-2-enyl-pyrrol-2-ylidene]propanedinitrile Openeye Name: 2-[1-allyl-4-(1-butyl-2,2,4-trimethyl-6-quinolyl)-3-cyano-5-oxo-pyrrol-2-ylidene]propanedinitrile CAS Name: 2-[4-(1-butyl-2,2,4-trimethyl-6-quinolinyl)-3-cyano-5-oxo-1-prop-2-enyl-2-pyrrolylidene]propanedinitrile IUPAC Name: 2-[4-(1-butyl-2,2,4-trimethylquinolin-6-yl)-3-cyano-5-oxo-1-prop-2-enylpyrrol-2-ylidene]propanedinitrile Traditional Name: 2-[1-allyl-4-(1-butyl-2,2,4-trimethyl-6-quinolyl)-3-cyano-5-keto-3-pyrrolin-2-ylidene]malononitrile Formula: C27H27N5O MolecularWeight: 437.53618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C3=C(C(=C(C#N)C#N)N(C3=O)CC=C)C#N)C(=CC1(C)C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C3=C(C(=C(C#N)C#N)N(C3=O)CC=C)C#N)C(=CC1(C)C)C

InChI

InChI=1S/C27H27N5O/c1-6-8-12-32-23-10-9-19(13-21(23)18(3)14-27(32,4)5)24-22(17-30)25(20(15-28)16-29)31(11-7-2)26(24)33/h7,9-10,13-14H,2,6,8,11-12H2,1,3-5H3