2-(4-heptoxyphenyl)-3,1-benzoxazin-4-one

Systemtic Name: 2-(4-heptoxyphenyl)-3,1-benzoxazin-4-one Openeye Name: 2-(4-heptoxyphenyl)-3,1-benzoxazin-4-one CAS Name: 2-(4-heptoxyphenyl)-3,1-benzoxazin-4-one IUPAC Name: 2-(4-heptoxyphenyl)-3,1-benzoxazin-4-one Traditional Name: 2-(4-heptoxyphenyl)-3,1-benzoxazin-4-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C21H23NO3/c1-2-3-4-5-8-15-24-17-13-11-16(12-14-17)20-22-19-10-7-6-9-18(19)21(23)25-20/h6-7,9-14H,2-5,8,15H2,1H3