aminocarbonyl (4Z)-4-aminocarbonyloxy-2-(5-azanylisoquinolin-1-yl)-4-hydroxyimino-butanoate

Systemtic Name: aminocarbonyl (4Z)-4-aminocarbonyloxy-2-(5-azanylisoquinolin-1-yl)-4-hydroxyimino-butanoate Openeye Name: carbamoyl (4Z)-2-(5-amino-1-isoquinolyl)-4-carbamoyloxy-4-hydroxyimino-butanoate CAS Name: (4Z)-2-(5-amino-1-isoquinolinyl)-4-carbamoyloxy-4-hydroxyiminobutanoic acid carbamoyl ester IUPAC Name: carbamoyl (4Z)-2-(5-aminoisoquinolin-1-yl)-4-carbamoyloxy-4-hydroxyiminobutanoate Traditional Name: (4Z)-2-(5-amino-1-isoquinolyl)-4-carbamoyloxy-4-hydroximino-butyric acid carbamoyl ester Formula: C15H15N5O6 MolecularWeight: 361.3095

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2C(CC(=NO)OC(=O)N)C(=O)OC(=O)N)C(=C1)N

Isomeric SMILES

C1=CC2=C(C=CN=C2C(C/C(=N/O)/OC(=O)N)C(=O)OC(=O)N)C(=C1)N

InChI

InChI=1S/C15H15N5O6/c16-10-3-1-2-8-7(10)4-5-19-12(8)9(13(21)26-15(18)23)6-11(20-24)25-14(17)22/h1-5,9,24H,6,16H2,(H2,17,22)(H2,18,23)/b20-11-