N-(3-azanylidene-1H-isoindol-2-yl)-4-(ethylamino)-3-nitro-benzamide

Systemtic Name: N-(3-azanylidene-1H-isoindol-2-yl)-4-(ethylamino)-3-nitro-benzamide Openeye Name: 4-(ethylamino)-N-(1-iminoisoindolin-2-yl)-3-nitro-benzamide CAS Name: 4-(ethylamino)-N-(3-imino-1H-isoindol-2-yl)-3-nitrobenzamide IUPAC Name: 4-(ethylamino)-N-(3-imino-1H-isoindol-2-yl)-3-nitrobenzamide Traditional Name: 4-(ethylamino)-N-(1-iminoisoindolin-2-yl)-3-nitro-benzamide Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)NN2CC3=CC=CC=C3C2=N)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)NN2CC3=CC=CC=C3C2=N)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3/c1-2-19-14-8-7-11(9-15(14)22(24)25)17(23)20-21-10-12-5-3-4-6-13(12)16(21)18/h3-9,18-19H,2,10H2,1H3,(H,20,23)