2-[(4-methoxyphenyl)amino]-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-[(4-methoxyphenyl)amino]-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]ethanamide Openeye Name: 2-(4-methoxyanilino)-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methyleneamino]acetamide CAS Name: 2-(4-methoxyanilino)-N-[(E)-[5-nitro-2-(1-pyrrolidinyl)phenyl]methylideneamino]acetamide IUPAC Name: 2-(4-methoxyanilino)-N-[(E)-(5-nitro-2-pyrrolidin-1-ylphenyl)methylideneamino]acetamide Traditional Name: N-[(E)-(5-nitro-2-pyrrolidino-benzylidene)amino]-2-(p-anisidino)acetamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NCC(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NCC(=O)N/N=C/C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C20H23N5O4/c1-29-18-7-4-16(5-8-18)21-14-20(26)23-22-13-15-12-17(25(27)28)6-9-19(15)24-10-2-3-11-24/h4-9,12-13,21H,2-3,10-11,14H2,1H3,(H,23,26)/b22-13+