4-[3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-1,4-benzoxazin-3-one Openeye Name: 4-[3-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-oxo-propyl]-1,4-benzoxazin-3-one CAS Name: 4-[3-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-3-oxopropyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[3-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxopropyl]-1,4-benzoxazin-3-one Traditional Name: 4-[3-[4-(3-fluoro-4-methoxy-benzyl)piperazino]-3-keto-propyl]-1,4-benzoxazin-3-one Formula: C23H26FN3O4 MolecularWeight: 427.468643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CCN3C(=O)COC4=CC=CC=C43)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CCN3C(=O)COC4=CC=CC=C43)F

InChI

InChI=1S/C23H26FN3O4/c1-30-20-7-6-17(14-18(20)24)15-25-10-12-26(13-11-25)22(28)8-9-27-19-4-2-3-5-21(19)31-16-23(27)29/h2-7,14H,8-13,15-16H2,1H3