(E)-4-[6-chloranyl-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one

Systemtic Name: (E)-4-[6-chloranyl-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one Openeye Name: (E)-4-[6-chloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one CAS Name: (E)-4-[6-chloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]-3-buten-2-one IUPAC Name: (E)-4-[6-chloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one Traditional Name: (E)-4-[6-chloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=C(NC2=C1C=CC(=C2)Cl)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)/C=C/C1=C(NC2=C1C=CC(=C2)Cl)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H18ClNO3/c1-12(23)4-7-16-15-8-6-14(21)11-17(15)22-20(16)13-5-9-18(24-2)19(10-13)25-3/h4-11,22H,1-3H3/b7-4+