2-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-3-nitro-benzamide

Systemtic Name: 2-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[4-(4-morpholin-4-iumylmethyl)phenyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-3-nitrobenzamide Traditional Name: 2-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-3-nitro-benzamide Formula: C19H22N3O4+ MolecularWeight: 356.39568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C19H21N3O4/c1-14-17(3-2-4-18(14)22(24)25)19(23)20-16-7-5-15(6-8-16)13-21-9-11-26-12-10-21/h2-8H,9-13H2,1H3,(H,20,23)/p+1