2-[(4-azanyl-1,2,5-oxadiazol-3-yl)carbonylamino]ethyl-[(3-phenylmethoxyphenyl)methyl]azanium

Systemtic Name: 2-[(4-azanyl-1,2,5-oxadiazol-3-yl)carbonylamino]ethyl-[(3-phenylmethoxyphenyl)methyl]azanium Openeye Name: 2-[(4-amino-1,2,5-oxadiazole-3-carbonyl)amino]ethyl-[(3-benzyloxyphenyl)methyl]ammonium CAS Name: 2-[[(4-amino-1,2,5-oxadiazol-3-yl)-oxomethyl]amino]ethyl-[(3-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: 2-[(4-amino-1,2,5-oxadiazole-3-carbonyl)amino]ethyl-[(3-phenylmethoxyphenyl)methyl]azanium Traditional Name: 2-[(4-aminofurazan-3-carbonyl)amino]ethyl-(3-benzoxybenzyl)ammonium Formula: C19H22N5O3+ MolecularWeight: 368.40968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C[NH2+]CCNC(=O)C3=NON=C3N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C[NH2+]CCNC(=O)C3=NON=C3N

InChI

InChI=1S/C19H21N5O3/c20-18-17(23-27-24-18)19(25)22-10-9-21-12-15-7-4-8-16(11-15)26-13-14-5-2-1-3-6-14/h1-8,11,21H,9-10,12-13H2,(H2,20,24)(H,22,25)/p+1