methyl 4-[3-butyl-1,4-bis(oxidanylidene)naphthalen-2-yl]benzoate

Systemtic Name: methyl 4-[3-butyl-1,4-bis(oxidanylidene)naphthalen-2-yl]benzoate Openeye Name: methyl 4-(3-butyl-1,4-dioxo-2-naphthyl)benzoate CAS Name: 4-(3-butyl-1,4-dioxo-2-naphthalenyl)benzoic acid methyl ester IUPAC Name: methyl 4-(3-butyl-1,4-dioxonaphthalen-2-yl)benzoate Traditional Name: 4-(3-butyl-1,4-diketo-2-naphthyl)benzoic acid methyl ester Formula: C22H20O4 MolecularWeight: 348.3918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C2=CC=CC=C2C1=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=O)C2=CC=CC=C2C1=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H20O4/c1-3-4-7-18-19(14-10-12-15(13-11-14)22(25)26-2)21(24)17-9-6-5-8-16(17)20(18)23/h5-6,8-13H,3-4,7H2,1-2H3