N-(2-hydroxyethyl)-4-nitro-N-octan-2-yl-benzamide

Systemtic Name: N-(2-hydroxyethyl)-4-nitro-N-octan-2-yl-benzamide Openeye Name: N-(2-hydroxyethyl)-N-(1-methylheptyl)-4-nitro-benzamide CAS Name: N-(2-hydroxyethyl)-4-nitro-N-octan-2-ylbenzamide IUPAC Name: N-(2-hydroxyethyl)-4-nitro-N-octan-2-ylbenzamide Traditional Name: N-(2-hydroxyethyl)-N-(1-methylheptyl)-4-nitro-benzamide Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)N(CCO)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC(C)N(CCO)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C17H26N2O4/c1-3-4-5-6-7-14(2)18(12-13-20)17(21)15-8-10-16(11-9-15)19(22)23/h8-11,14,20H,3-7,12-13H2,1-2H3