N-[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-5H-indazolo[2,3-a][3,1]benzoxazine-9-carboxamide

Systemtic Name: N-[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-5H-indazolo[2,3-a][3,1]benzoxazine-9-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-methyl-propyl]-5H-indazolo[2,3-a][3,1]benzoxazine-9-carboxamide CAS Name: N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5H-indazolo[2,3-a][3,1]benzoxazine-9-carboxamide IUPAC Name: N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5H-indazolo[2,3-a][3,1]benzoxazine-9-carboxamide Traditional Name: N-[(1S)-2-methyl-1-methylol-propyl]-5H-indazolo[2,3-a][3,1]benzoxazine-9-carboxamide Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)NC(=O)C1=CC2=NN3C4=CC=CC=C4COC3=C2C=C1

Isomeric SMILES

CC(C)[C@@H](CO)NC(=O)C1=CC2=NN3C4=CC=CC=C4COC3=C2C=C1

InChI

InChI=1S/C20H21N3O3/c1-12(2)17(10-24)21-19(25)13-7-8-15-16(9-13)22-23-18-6-4-3-5-14(18)11-26-20(15)23/h3-9,12,17,24H,10-11H2,1-2H3,(H,21,25)/t17-/m1/s1