2-benzamido-N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide

Systemtic Name: 2-benzamido-N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide Openeye Name: 2-benzamido-N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide CAS Name: 2-benzamido-N-[2-(4-morpholin-4-iumyl)ethyl]-4-nitrobenzamide IUPAC Name: 2-benzamido-N-(2-morpholin-4-ium-4-ylethyl)-4-nitrobenzamide Traditional Name: 2-benzamido-N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide Formula: C20H23N4O5+ MolecularWeight: 399.42042

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O5/c25-19(15-4-2-1-3-5-15)22-18-14-16(24(27)28)6-7-17(18)20(26)21-8-9-23-10-12-29-13-11-23/h1-7,14H,8-13H2,(H,21,26)(H,22,25)/p+1