[4-oxidanyl-2-(2-oxidanylidenepropyl)naphthalen-1-yl] 4-methylbenzoate

Systemtic Name: [4-oxidanyl-2-(2-oxidanylidenepropyl)naphthalen-1-yl] 4-methylbenzoate Openeye Name: (2-acetonyl-4-hydroxy-1-naphthyl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-hydroxy-2-(2-oxopropyl)-1-naphthalenyl] ester IUPAC Name: [4-hydroxy-2-(2-oxopropyl)naphthalen-1-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (2-acetonyl-4-hydroxy-1-naphthyl) ester Formula: C21H18O4 MolecularWeight: 334.36522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C3=CC=CC=C32)O)CC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C3=CC=CC=C32)O)CC(=O)C

InChI

InChI=1S/C21H18O4/c1-13-7-9-15(10-8-13)21(24)25-20-16(11-14(2)22)12-19(23)17-5-3-4-6-18(17)20/h3-10,12,23H,11H2,1-2H3