4-(6-chloranylindazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(6-chloranylindazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-butanamide Openeye Name: 4-(6-chloroindazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-butanamide CAS Name: 4-(6-chloro-1-indazolyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxobutanamide IUPAC Name: 4-(6-chloroindazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxobutanamide Traditional Name: 4-(6-chloroindazol-1-yl)-N-homoveratryl-4-keto-butyramide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCC(=O)N2C3=C(C=CC(=C3)Cl)C=N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCC(=O)N2C3=C(C=CC(=C3)Cl)C=N2)OC

InChI

InChI=1S/C21H22ClN3O4/c1-28-18-6-3-14(11-19(18)29-2)9-10-23-20(26)7-8-21(27)25-17-12-16(22)5-4-15(17)13-24-25/h3-6,11-13H,7-10H2,1-2H3,(H,23,26)