[azanyl-[(2-benzamidophenyl)carbonylamino]methylidene]-(1,3-benzoxazol-2-yl)azanium

Systemtic Name: [azanyl-[(2-benzamidophenyl)carbonylamino]methylidene]-(1,3-benzoxazol-2-yl)azanium Openeye Name: [amino-[(2-benzamidobenzoyl)amino]methylene]-(1,3-benzoxazol-2-yl)ammonium CAS Name: [amino-[[(2-benzamidophenyl)-oxomethyl]amino]methylidene]-(1,3-benzoxazol-2-yl)ammonium IUPAC Name: [amino-[(2-benzamidobenzoyl)amino]methylidene]-(1,3-benzoxazol-2-yl)azanium Traditional Name: [amino-[(2-benzamidobenzoyl)amino]methylene]-(1,3-benzoxazol-2-yl)ammonium Formula: C22H18N5O3+ MolecularWeight: 400.41002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NC(=[NH+]C3=NC4=CC=CC=C4O3)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NC(=[NH+]C3=NC4=CC=CC=C4O3)N

InChI

InChI=1S/C22H17N5O3/c23-21(27-22-25-17-12-6-7-13-18(17)30-22)26-20(29)15-10-4-5-11-16(15)24-19(28)14-8-2-1-3-9-14/h1-13H,(H,24,28)(H3,23,25,26,27,29)/p+1