1-[benzotriazol-1-yl(morpholin-4-ium-4-ylidene)methyl]-3-phenyl-urea

Systemtic Name: 1-[benzotriazol-1-yl(morpholin-4-ium-4-ylidene)methyl]-3-phenyl-urea Openeye Name: 1-[benzotriazol-1-yl(morpholin-4-ium-4-ylidene)methyl]-3-phenyl-urea CAS Name: 1-[1-benzotriazolyl(4-morpholin-4-iumylidene)methyl]-3-phenylurea IUPAC Name: 1-[benzotriazol-1-yl(morpholin-4-ium-4-ylidene)methyl]-3-phenylurea Traditional Name: 1-[benzotriazol-1-yl(morpholin-4-ium-4-ylidene)methyl]-3-phenyl-urea Formula: C18H19N6O2+ MolecularWeight: 351.38246

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1=C(NC(=O)NC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1COCC[N+]1=C(NC(=O)NC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H18N6O2/c25-17(19-14-6-2-1-3-7-14)20-18(23-10-12-26-13-11-23)24-16-9-5-4-8-15(16)21-22-24/h1-9H,10-13H2,(H,19,25)/p+1