4-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-anilino)-3-nitro-benzonitrile CAS Name: 4-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)anilino]-3-nitrobenzonitrile IUPAC Name: 4-(4-ethoxy-3-pyrrolidin-1-ylsulfonylanilino)-3-nitrobenzonitrile Traditional Name: 4-(4-ethoxy-3-pyrrolidinosulfonyl-anilino)-3-nitro-benzonitrile Formula: C19H20N4O5S MolecularWeight: 416.4509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H20N4O5S/c1-2-28-18-8-6-15(12-19(18)29(26,27)22-9-3-4-10-22)21-16-7-5-14(13-20)11-17(16)23(24)25/h5-8,11-12,21H,2-4,9-10H2,1H3