4-(cyclopropylamino)-N-(6-methylheptan-2-yl)-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-(6-methylheptan-2-yl)-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-(1,5-dimethylhexyl)-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-(6-methylheptan-2-yl)-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-(6-methylheptan-2-yl)-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-(1,5-dimethylhexyl)-3-nitro-benzamide Formula: C18H27N3O3 MolecularWeight: 333.42528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCC(C)NC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O3/c1-12(2)5-4-6-13(3)19-18(22)14-7-10-16(20-15-8-9-15)17(11-14)21(23)24/h7,10-13,15,20H,4-6,8-9H2,1-3H3,(H,19,22)