N-(2-methylcyclohexyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(2-methylcyclohexyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(2-methylcyclohexyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(2-methylcyclohexyl)-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(2-methylcyclohexyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(2-methylcyclohexyl)-3-nitro-4-pyrrolidino-benzamide Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCC1NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O3/c1-13-6-2-3-7-15(13)19-18(22)14-8-9-16(17(12-14)21(23)24)20-10-4-5-11-20/h8-9,12-13,15H,2-7,10-11H2,1H3,(H,19,22)