4-(ethylamino)-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(ethylamino)-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-(ethylamino)-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3-nitro-benzamide CAS Name: 4-(ethylamino)-N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-(ethylamino)-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-(ethylamino)-N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]-3-nitro-benzamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c1-3-21-15-8-6-13(11-17(15)24(27)28)20(26)22-14-7-9-16(18(12-14)29-2)23-10-4-5-19(23)25/h6-9,11-12,21H,3-5,10H2,1-2H3,(H,22,26)