3-[4-(2,3,5-trimethylphenoxy)butyl]quinazolin-4-one

Systemtic Name: 3-[4-(2,3,5-trimethylphenoxy)butyl]quinazolin-4-one Openeye Name: 3-[4-(2,3,5-trimethylphenoxy)butyl]quinazolin-4-one CAS Name: 3-[4-(2,3,5-trimethylphenoxy)butyl]-4-quinazolinone IUPAC Name: 3-[4-(2,3,5-trimethylphenoxy)butyl]quinazolin-4-one Traditional Name: 3-[4-(2,3,5-trimethylphenoxy)butyl]quinazolin-4-one Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCCN2C=NC3=CC=CC=C3C2=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCCN2C=NC3=CC=CC=C3C2=O)C)C

InChI

InChI=1S/C21H24N2O2/c1-15-12-16(2)17(3)20(13-15)25-11-7-6-10-23-14-22-19-9-5-4-8-18(19)21(23)24/h4-5,8-9,12-14H,6-7,10-11H2,1-3H3