2-hydroxyethyl (2E)-2-(6-methyl-3-oxidanylidene-1-benzofuran-2-ylidene)-2-(4-methylpiperazin-1-yl)ethanoate

Systemtic Name: 2-hydroxyethyl (2E)-2-(6-methyl-3-oxidanylidene-1-benzofuran-2-ylidene)-2-(4-methylpiperazin-1-yl)ethanoate Openeye Name: 2-hydroxyethyl (2E)-2-(6-methyl-3-oxo-benzofuran-2-ylidene)-2-(4-methylpiperazin-1-yl)acetate CAS Name: (2E)-2-(6-methyl-3-oxo-2-benzofuranylidene)-2-(4-methyl-1-piperazinyl)acetic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl (2E)-2-(6-methyl-3-oxo-1-benzofuran-2-ylidene)-2-(4-methylpiperazin-1-yl)acetate Traditional Name: (2E)-2-(3-keto-6-methyl-coumaran-2-ylidene)-2-(4-methylpiperazino)acetic acid 2-hydroxyethyl ester Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C(C(=O)OCCO)N3CCN(CC3)C)O2

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)/C(=C(/C(=O)OCCO)\N3CCN(CC3)C)/O2

InChI

InChI=1S/C18H22N2O5/c1-12-3-4-13-14(11-12)25-17(16(13)22)15(18(23)24-10-9-21)20-7-5-19(2)6-8-20/h3-4,11,21H,5-10H2,1-2H3/b17-15+