1-(4-nitrophenyl)-2-oxidanylidene-7-(2-pyrrolidin-1-ylethylamino)quinoline-3-carbonitrile

Systemtic Name: 1-(4-nitrophenyl)-2-oxidanylidene-7-(2-pyrrolidin-1-ylethylamino)quinoline-3-carbonitrile Openeye Name: 1-(4-nitrophenyl)-2-oxo-7-(2-pyrrolidin-1-ylethylamino)quinoline-3-carbonitrile CAS Name: 1-(4-nitrophenyl)-2-oxo-7-[2-(1-pyrrolidinyl)ethylamino]-3-quinolinecarbonitrile IUPAC Name: 1-(4-nitrophenyl)-2-oxo-7-(2-pyrrolidin-1-ylethylamino)quinoline-3-carbonitrile Traditional Name: 2-keto-1-(4-nitrophenyl)-7-(2-pyrrolidinoethylamino)quinoline-3-carbonitrile Formula: C22H21N5O3 MolecularWeight: 403.43384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC2=CC3=C(C=C2)C=C(C(=O)N3C4=CC=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCN(C1)CCNC2=CC3=C(C=C2)C=C(C(=O)N3C4=CC=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C22H21N5O3/c23-15-17-13-16-3-4-18(24-9-12-25-10-1-2-11-25)14-21(16)26(22(17)28)19-5-7-20(8-6-19)27(29)30/h3-8,13-14,24H,1-2,9-12H2