4-[3-[ethyl(phenyl)amino]propylamino]-3-nitro-benzamide

Systemtic Name: 4-[3-[ethyl(phenyl)amino]propylamino]-3-nitro-benzamide Openeye Name: 4-[3-(N-ethylanilino)propylamino]-3-nitro-benzamide CAS Name: 4-[3-(N-ethylanilino)propylamino]-3-nitrobenzamide IUPAC Name: 4-[3-(N-ethylanilino)propylamino]-3-nitrobenzamide Traditional Name: 4-[3-(N-ethylanilino)propylamino]-3-nitro-benzamide Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CCN(CCCNC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C18H22N4O3/c1-2-21(15-7-4-3-5-8-15)12-6-11-20-16-10-9-14(18(19)23)13-17(16)22(24)25/h3-5,7-10,13,20H,2,6,11-12H2,1H3,(H2,19,23)