4-[(4-methylphenyl)methyl]-7-(2-phenylbutyl)-1,4-benzoxazin-3-one

Systemtic Name: 4-[(4-methylphenyl)methyl]-7-(2-phenylbutyl)-1,4-benzoxazin-3-one Openeye Name: 7-(2-phenylbutyl)-4-(p-tolylmethyl)-1,4-benzoxazin-3-one CAS Name: 4-[(4-methylphenyl)methyl]-7-(2-phenylbutyl)-1,4-benzoxazin-3-one IUPAC Name: 4-[(4-methylphenyl)methyl]-7-(2-phenylbutyl)-1,4-benzoxazin-3-one Traditional Name: 4-(4-methylbenzyl)-7-(2-phenylbutyl)-1,4-benzoxazin-3-one Formula: C26H27NO2 MolecularWeight: 385.49808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCC(CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C26H27NO2/c1-3-22(23-7-5-4-6-8-23)15-21-13-14-24-25(16-21)29-18-26(28)27(24)17-20-11-9-19(2)10-12-20/h4-14,16,22H,3,15,17-18H2,1-2H3