[4-[(Z)-(2-morpholin-4-ium-4-ylethanoylhydrazinylidene)methyl]phenyl] 4-methoxybenzoate

Systemtic Name: [4-[(Z)-(2-morpholin-4-ium-4-ylethanoylhydrazinylidene)methyl]phenyl] 4-methoxybenzoate Openeye Name: [4-[(Z)-[(2-morpholin-4-ium-4-ylacetyl)hydrazono]methyl]phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [4-[(Z)-[[2-(4-morpholin-4-iumyl)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(Z)-[(2-morpholin-4-ium-4-ylacetyl)hydrazinylidene]methyl]phenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [4-[(Z)-[(2-morpholin-4-ium-4-ylacetyl)hydrazono]methyl]phenyl] ester Formula: C21H24N3O5+ MolecularWeight: 398.43236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N\NC(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C21H23N3O5/c1-27-18-8-4-17(5-9-18)21(26)29-19-6-2-16(3-7-19)14-22-23-20(25)15-24-10-12-28-13-11-24/h2-9,14H,10-13,15H2,1H3,(H,23,25)/p+1/b22-14-