4-cyanopentanoate; (2-hydroxyphenyl)-phenyl-methanone

Systemtic Name: 4-cyanopentanoate; (2-hydroxyphenyl)-phenyl-methanone Openeye Name: 4-cyanopentanoate; (2-hydroxyphenyl)-phenyl-methanone CAS Name: 4-cyanopentanoate; (2-hydroxyphenyl)-phenylmethanone IUPAC Name: 4-cyanopentanoate; (2-hydroxyphenyl)-phenylmethanone Traditional Name: 4-cyanovalerate; (2-hydroxyphenyl)-phenyl-methanone Formula: C19H18NO4- MolecularWeight: 324.35052

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)[O-])C#N.C1=CC=C(C=C1)C(=O)C2=CC=CC=C2O

Isomeric SMILES

CC(CCC(=O)[O-])C#N.C1=CC=C(C=C1)C(=O)C2=CC=CC=C2O

InChI

InChI=1S/C13H10O2.C6H9NO2/c14-12-9-5-4-8-11(12)13(15)10-6-2-1-3-7-10;1-5(4-7)2-3-6(8)9/h1-9,14H;5H,2-3H2,1H3,(H,8,9)/p-1