benzaldehyde; methanal; propan-2-one

Systemtic Name: benzaldehyde; methanal; propan-2-one Openeye Name: acetone; benzaldehyde; formaldehyde CAS Name: benzaldehyde; formaldehyde; 2-propanone IUPAC Name: benzaldehyde; formaldehyde; propan-2-one Traditional Name: acetone; benzaldehyde; formaldehyde Formula: C11H14O3 MolecularWeight: 194.22706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6O.C3H6O.CH2O/c8-6-7-4-2-1-3-5-7;1-3(2)4;1-2/h1-6H;1-2H3;1H2