N-[(E)-(2-chloranylquinolin-3-yl)methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(E)-(2-chloranylquinolin-3-yl)methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(E)-(2-chloro-3-quinolyl)methyleneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(E)-(2-chloro-3-quinolinyl)methylideneamino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(E)-(2-chloroquinolin-3-yl)methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(E)-(2-chloro-3-quinolyl)methyleneamino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C20H18ClN5O4S MolecularWeight: 459.90602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC4=CC=CC=C4N=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=CC4=CC=CC=C4N=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN5O4S/c21-20-15(11-14-5-1-2-6-17(14)23-20)13-22-24-18-8-7-16(12-19(18)26(27)28)31(29,30)25-9-3-4-10-25/h1-2,5-8,11-13,24H,3-4,9-10H2/b22-13+