2-diethylaminoethyl 2-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]benzoate

Systemtic Name: 2-diethylaminoethyl 2-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]benzoate Openeye Name: 2-diethylaminoethyl 2-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]amino]benzoate CAS Name: 2-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]amino]benzoate Traditional Name: 2-[[(E)-(3-keto-2-methyl-5-methylol-4-pyridylidene)methyl]amino]benzoic acid 2-diethylaminoethyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=CC=C1NC=C2C(=CN=C(C2=O)C)CO

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=CC=C1N/C=C/2\C(=CN=C(C2=O)C)CO

InChI

InChI=1S/C21H27N3O4/c1-4-24(5-2)10-11-28-21(27)17-8-6-7-9-19(17)23-13-18-16(14-25)12-22-15(3)20(18)26/h6-9,12-13,23,25H,4-5,10-11,14H2,1-3H3/b18-13+