2-(1H-quinolin-4-ylidene)propanedial hydrate

Systemtic Name: 2-(1H-quinolin-4-ylidene)propanedial hydrate Openeye Name: 2-(1H-quinolin-4-ylidene)propanedial hydrate CAS Name: 2-(1H-quinolin-4-ylidene)propanedial hydrate IUPAC Name: 2-(1H-quinolin-4-ylidene)propanedial hydrate Traditional Name: 2-(1H-quinolin-4-ylidene)malonaldehyde hydrate Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=O)C=O)C=CN2.O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=O)C=O)C=CN2.O

InChI

InChI=1S/C12H9NO2.H2O/c14-7-9(8-15)10-5-6-13-12-4-2-1-3-11(10)12;/h1-8,13H;1H2