6-chloranyl-3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2H-1,3-benzoxazin-4-one

Systemtic Name: 6-chloranyl-3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2H-1,3-benzoxazin-4-one Openeye Name: 6-chloro-3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2H-1,3-benzoxazin-4-one CAS Name: 6-chloro-3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2H-1,3-benzoxazin-4-one IUPAC Name: 6-chloro-3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2H-1,3-benzoxazin-4-one Traditional Name: 6-chloro-3-[3-(homoveratrylamino)propyl]-2H-1,3-benzoxazin-4-one Formula: C21H25ClN2O4 MolecularWeight: 404.8872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCCN2COC3=C(C2=O)C=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCCN2COC3=C(C2=O)C=C(C=C3)Cl)OC

InChI

InChI=1S/C21H25ClN2O4/c1-26-19-6-4-15(12-20(19)27-2)8-10-23-9-3-11-24-14-28-18-7-5-16(22)13-17(18)21(24)25/h4-7,12-13,23H,3,8-11,14H2,1-2H3