1-[3-[(4-methoxyphenyl)methyl]-2-oxidanylidene-3-propan-2-yl-1,3-benzoxazol-3-ium-5-yl]urea

Systemtic Name: 1-[3-[(4-methoxyphenyl)methyl]-2-oxidanylidene-3-propan-2-yl-1,3-benzoxazol-3-ium-5-yl]urea Openeye Name: [3-isopropyl-3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-benzoxazol-3-ium-5-yl]urea CAS Name: [3-[(4-methoxyphenyl)methyl]-2-oxo-3-propan-2-yl-1,3-benzoxazol-3-ium-5-yl]urea IUPAC Name: [3-[(4-methoxyphenyl)methyl]-2-oxo-3-propan-2-yl-1,3-benzoxazol-3-ium-5-yl]urea Traditional Name: (3-isopropyl-2-keto-3-p-anisyl-1,3-benzoxazol-3-ium-5-yl)urea Formula: C19H22N3O4+ MolecularWeight: 356.39568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(C2=C(C=CC(=C2)NC(=O)N)OC1=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)[N+]1(C2=C(C=CC(=C2)NC(=O)N)OC1=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H21N3O4/c1-12(2)22(11-13-4-7-15(25-3)8-5-13)16-10-14(21-18(20)23)6-9-17(16)26-19(22)24/h4-10,12H,11H2,1-3H3,(H2-,20,21,23)/p+1