4-(ethylamino)-3-nitro-N-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]benzamide

Systemtic Name: 4-(ethylamino)-3-nitro-N-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]benzamide Openeye Name: 4-(ethylamino)-3-nitro-N-[(E)-(4-pyrrolidin-1-ylphenyl)methyleneamino]benzamide CAS Name: 4-(ethylamino)-3-nitro-N-[(E)-[4-(1-pyrrolidinyl)phenyl]methylideneamino]benzamide IUPAC Name: 4-(ethylamino)-3-nitro-N-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]benzamide Traditional Name: 4-(ethylamino)-3-nitro-N-[(E)-(4-pyrrolidinobenzylidene)amino]benzamide Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)NN=CC2=CC=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O3/c1-2-21-18-10-7-16(13-19(18)25(27)28)20(26)23-22-14-15-5-8-17(9-6-15)24-11-3-4-12-24/h5-10,13-14,21H,2-4,11-12H2,1H3,(H,23,26)/b22-14+