N1-(2-dimethylaminoethyl)-2-nitro-N3-phenyl-benzene-1,3-dicarboxamide hydrochloride

Systemtic Name: N1-(2-dimethylaminoethyl)-2-nitro-N3-phenyl-benzene-1,3-dicarboxamide hydrochloride Openeye Name: N1-(2-dimethylaminoethyl)-2-nitro-N3-phenyl-benzene-1,3-dicarboxamide hydrochloride CAS Name: N1-(2-dimethylaminoethyl)-2-nitro-N3-phenylbenzene-1,3-dicarboxamide hydrochloride IUPAC Name: 1-N-(2-dimethylaminoethyl)-2-nitro-3-N-phenylbenzene-1,3-dicarboxamide hydrochloride Traditional Name: N-(2-dimethylaminoethyl)-2-nitro-N'-phenyl-isophthalamide hydrochloride Formula: C18H21ClN4O4 MolecularWeight: 392.83674

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2.Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2.Cl

InChI

InChI=1S/C18H20N4O4.ClH/c1-21(2)12-11-19-17(23)14-9-6-10-15(16(14)22(25)26)18(24)20-13-7-4-3-5-8-13;/h3-10H,11-12H2,1-2H3,(H,19,23)(H,20,24);1H