propan-2-yl 4-(methoxymethyl)-6-(2-methylsulfonylpyrimidin-4-yl)oxy-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: propan-2-yl 4-(methoxymethyl)-6-(2-methylsulfonylpyrimidin-4-yl)oxy-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: isopropyl 4-(methoxymethyl)-6-(2-methylsulfonylpyrimidin-4-yl)oxy-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 4-(methoxymethyl)-6-[(2-methylsulfonyl-4-pyrimidinyl)oxy]-9H-pyrido[3,4-b]indole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(methoxymethyl)-6-(2-methylsulfonylpyrimidin-4-yl)oxy-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-(2-mesylpyrimidin-4-yl)oxy-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid isopropyl ester Formula: C22H22N4O6S MolecularWeight: 470.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OC4=NC(=NC=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OC4=NC(=NC=C4)S(=O)(=O)C

InChI

InChI=1S/C22H22N4O6S/c1-12(2)31-21(27)20-15(11-30-3)19-14-9-13(5-6-16(14)25-17(19)10-24-20)32-18-7-8-23-22(26-18)33(4,28)29/h5-10,12,25H,11H2,1-4H3