(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-methyl-azanium

Systemtic Name: (6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-methyl-azanium Openeye Name: (6-chloro-2-oxo-1,3-benzoxazol-3-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-methyl-ammonium CAS Name: (6-chloro-2-oxo-1,3-benzoxazol-3-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-methylammonium IUPAC Name: (6-chloro-2-oxo-1,3-benzoxazol-3-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-methylazanium Traditional Name: (4-carbomethoxybenzyl)-[(6-chloro-2-keto-1,3-benzoxazol-3-yl)methyl]-methyl-ammonium Formula: C18H18ClN2O4+ MolecularWeight: 361.79952

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C(=O)OC)CN2C3=C(C=C(C=C3)Cl)OC2=O

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C(=O)OC)CN2C3=C(C=C(C=C3)Cl)OC2=O

InChI

InChI=1S/C18H17ClN2O4/c1-20(10-12-3-5-13(6-4-12)17(22)24-2)11-21-15-8-7-14(19)9-16(15)25-18(21)23/h3-9H,10-11H2,1-2H3/p+1