2-[(Z)-1-chloranyl-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)ethenyl]-3,1-benzoxazin-4-one

Systemtic Name: 2-[(Z)-1-chloranyl-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)ethenyl]-3,1-benzoxazin-4-one Openeye Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)vinyl]-3,1-benzoxazin-4-one CAS Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-prop-2-ynoxyphenyl)ethenyl]-3,1-benzoxazin-4-one IUPAC Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-prop-2-ynoxyphenyl)ethenyl]-3,1-benzoxazin-4-one Traditional Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-propargyloxy-phenyl)vinyl]-3,1-benzoxazin-4-one Formula: C21H16ClNO4 MolecularWeight: 381.80904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C2=NC3=CC=CC=C3C(=O)O2)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(/C2=NC3=CC=CC=C3C(=O)O2)\Cl)OCC#C

InChI

InChI=1S/C21H16ClNO4/c1-3-11-26-18-10-9-14(13-19(18)25-4-2)12-16(22)20-23-17-8-6-5-7-15(17)21(24)27-20/h1,5-10,12-13H,4,11H2,2H3/b16-12-