4-(morpholin-4-ium-4-ylmethyl)-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]benzamide

Systemtic Name: 4-(morpholin-4-ium-4-ylmethyl)-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]benzamide Openeye Name: 4-(morpholin-4-ium-4-ylmethyl)-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]benzamide CAS Name: 4-(4-morpholin-4-iumylmethyl)-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]benzamide IUPAC Name: 4-(morpholin-4-ium-4-ylmethyl)-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]benzamide Traditional Name: 4-(morpholin-4-ium-4-ylmethyl)-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]benzamide Formula: C20H23N4O4+ MolecularWeight: 383.42102

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)C[NH+]2CCOCC2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=C(C=C1)C[NH+]2CCOCC2)/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4/c1-15(18-3-2-4-19(13-18)24(26)27)21-22-20(25)17-7-5-16(6-8-17)14-23-9-11-28-12-10-23/h2-8,13H,9-12,14H2,1H3,(H,22,25)/p+1/b21-15-