N-[4-(morpholin-4-ylmethyl)phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-(morpholin-4-ylmethyl)phenyl]-3,5-dinitro-benzamide Openeye Name: N-[4-(morpholinomethyl)phenyl]-3,5-dinitro-benzamide CAS Name: N-[4-(4-morpholinylmethyl)phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-(morpholin-4-ylmethyl)phenyl]-3,5-dinitrobenzamide Traditional Name: N-[4-(morpholinomethyl)phenyl]-3,5-dinitro-benzamide Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CC2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6/c23-18(14-9-16(21(24)25)11-17(10-14)22(26)27)19-15-3-1-13(2-4-15)12-20-5-7-28-8-6-20/h1-4,9-11H,5-8,12H2,(H,19,23)