(3-ethoxycarbonyl-1,2-oxazol-5-yl)methyl-[(2-imidazol-1-ylphenyl)methyl]azanium

Systemtic Name: (3-ethoxycarbonyl-1,2-oxazol-5-yl)methyl-[(2-imidazol-1-ylphenyl)methyl]azanium Openeye Name: (3-ethoxycarbonylisoxazol-5-yl)methyl-[(2-imidazol-1-ylphenyl)methyl]ammonium CAS Name: (3-ethoxycarbonyl-5-isoxazolyl)methyl-[[2-(1-imidazolyl)phenyl]methyl]ammonium IUPAC Name: (3-ethoxycarbonyl-1,2-oxazol-5-yl)methyl-[(2-imidazol-1-ylphenyl)methyl]azanium Traditional Name: (3-carbethoxyisoxazol-5-yl)methyl-(2-imidazol-1-ylbenzyl)ammonium Formula: C17H19N4O3+ MolecularWeight: 327.35776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C[NH2+]CC2=CC=CC=C2N3C=CN=C3

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C[NH2+]CC2=CC=CC=C2N3C=CN=C3

InChI

InChI=1S/C17H18N4O3/c1-2-23-17(22)15-9-14(24-20-15)11-19-10-13-5-3-4-6-16(13)21-8-7-18-12-21/h3-9,12,19H,2,10-11H2,1H3/p+1