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1,3-benzoxazol-2-ylmethyl 1-oxidanylidene-2H-isoquinoline-3-carboxylate

1,3-benzoxazol-2-ylmethyl 1-oxidanylidene-2H-isoquinoline-3-carboxylate

Systemtic Name:1,3-benzoxazol-2-ylmethyl 1-oxidanylidene-2H-isoquinoline-3-carboxylate
Openeye Name:1,3-benzoxazol-2-ylmethyl 1-oxo-2H-isoquinoline-3-carboxylate
CAS Name:1-oxo-2H-isoquinoline-3-carboxylic acid 1,3-benzoxazol-2-ylmethyl ester
IUPAC Name:1,3-benzoxazol-2-ylmethyl 1-oxo-2H-isoquinoline-3-carboxylate
Traditional Name:1-keto-2H-isoquinoline-3-carboxylic acid 1,3-benzoxazol-2-ylmethyl ester
Formula: C18H12N2O4
MolecularWeight: 320.29888
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)OCC3=NC4=CC=CC=C4O3


Isomeric SMILES

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)OCC3=NC4=CC=CC=C4O3


InChI

InChI=1S/C18H12N2O4/c21-17-12-6-2-1-5-11(12)9-14(20-17)18(22)23-10-16-19-13-7-3-4-8-15(13)24-16/h1-9H,10H2,(H,20,21)


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