2-phenylethanoic acid; 3-propoxychromen-2-one

Systemtic Name: 2-phenylethanoic acid; 3-propoxychromen-2-one Openeye Name: 2-phenylacetic acid; 3-propoxychromen-2-one CAS Name: 2-phenylacetic acid; 3-propoxy-1-benzopyran-2-one IUPAC Name: 2-phenylacetic acid; 3-propoxychromen-2-one Traditional Name: 2-phenylacetic acid; 3-propoxycoumarin Formula: C20H20O5 MolecularWeight: 340.3698

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=CC=CC=C2OC1=O.C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CCCOC1=CC2=CC=CC=C2OC1=O.C1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C12H12O3.C8H8O2/c1-2-7-14-11-8-9-5-3-4-6-10(9)15-12(11)13;9-8(10)6-7-4-2-1-3-5-7/h3-6,8H,2,7H2,1H3;1-5H,6H2,(H,9,10)