1-[3-[6-(hydroxymethyl)pyridin-3-yl]carbonyl-6-methoxy-indazol-1-yl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[3-[6-(hydroxymethyl)pyridin-3-yl]carbonyl-6-methoxy-indazol-1-yl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[3-[6-(hydroxymethyl)pyridine-3-carbonyl]-6-methoxy-indazol-1-yl]-3,3-dimethyl-butan-2-one CAS Name: 1-[3-[[6-(hydroxymethyl)-3-pyridinyl]-oxomethyl]-6-methoxy-1-indazolyl]-3,3-dimethyl-2-butanone IUPAC Name: 1-[3-[6-(hydroxymethyl)pyridine-3-carbonyl]-6-methoxyindazol-1-yl]-3,3-dimethylbutan-2-one Traditional Name: 1-[6-methoxy-3-(6-methylolnicotinoyl)indazol-1-yl]-3,3-dimethyl-butan-2-one Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=C(C=CC(=C2)OC)C(=N1)C(=O)C3=CN=C(C=C3)CO

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=C(C=CC(=C2)OC)C(=N1)C(=O)C3=CN=C(C=C3)CO

InChI

InChI=1S/C21H23N3O4/c1-21(2,3)18(26)11-24-17-9-15(28-4)7-8-16(17)19(23-24)20(27)13-5-6-14(12-25)22-10-13/h5-10,25H,11-12H2,1-4H3