3-nitro-4-[2-(4-propan-2-ylphenyl)ethylamino]benzamide

Systemtic Name: 3-nitro-4-[2-(4-propan-2-ylphenyl)ethylamino]benzamide Openeye Name: 4-[2-(4-isopropylphenyl)ethylamino]-3-nitro-benzamide CAS Name: 3-nitro-4-[2-(4-propan-2-ylphenyl)ethylamino]benzamide IUPAC Name: 3-nitro-4-[2-(4-propan-2-ylphenyl)ethylamino]benzamide Traditional Name: 3-nitro-4-(2-p-cumenylethylamino)benzamide Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O3/c1-12(2)14-5-3-13(4-6-14)9-10-20-16-8-7-15(18(19)22)11-17(16)21(23)24/h3-8,11-12,20H,9-10H2,1-2H3,(H2,19,22)