methyl (Z)-2-[2-[(E)-N-acetyloxy-C-(5-cyanoisoquinolin-3-yl)carbonimidoyl]phenyl]-3-methoxy-prop-2-enoate

Systemtic Name: methyl (Z)-2-[2-[(E)-N-acetyloxy-C-(5-cyanoisoquinolin-3-yl)carbonimidoyl]phenyl]-3-methoxy-prop-2-enoate Openeye Name: methyl (Z)-2-[2-[(E)-N-acetoxy-C-(5-cyano-3-isoquinolyl)carbonimidoyl]phenyl]-3-methoxy-prop-2-enoate CAS Name: (Z)-2-[2-[(E)-acetyloxyimino-(5-cyano-3-isoquinolinyl)methyl]phenyl]-3-methoxy-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-[2-[(E)-N-acetyloxy-C-(5-cyanoisoquinolin-3-yl)carbonimidoyl]phenyl]-3-methoxyprop-2-enoate Traditional Name: (Z)-2-[2-[(E)-N-acetoxy-C-(5-cyano-3-isoquinolyl)carbonimidoyl]phenyl]-3-methoxy-acrylic acid methyl ester Formula: C24H19N3O5 MolecularWeight: 429.42476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON=C(C1=CC=CC=C1C(=COC)C(=O)OC)C2=CC3=C(C=CC=C3C=N2)C#N

Isomeric SMILES

CC(=O)O/N=C(\C1=CC=CC=C1/C(=C/OC)/C(=O)OC)/C2=CC3=C(C=CC=C3C=N2)C#N

InChI

InChI=1S/C24H19N3O5/c1-15(28)32-27-23(22-11-20-16(12-25)7-6-8-17(20)13-26-22)19-10-5-4-9-18(19)21(14-30-2)24(29)31-3/h4-11,13-14H,1-3H3/b21-14-,27-23+