tert-butyl 3-[(2-chloranyl-6-methoxy-pyridin-4-yl)carbonylamino]-3H-indole-2-carboxylate

Systemtic Name: tert-butyl 3-[(2-chloranyl-6-methoxy-pyridin-4-yl)carbonylamino]-3H-indole-2-carboxylate Openeye Name: tert-butyl 3-[(2-chloro-6-methoxy-pyridine-4-carbonyl)amino]-3H-indole-2-carboxylate CAS Name: 3-[[(2-chloro-6-methoxy-4-pyridinyl)-oxomethyl]amino]-3H-indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2-chloro-6-methoxypyridine-4-carbonyl)amino]-3H-indole-2-carboxylate Traditional Name: 3-[(2-chloro-6-methoxy-isonicotinoyl)amino]-3H-indole-2-carboxylic acid tert-butyl ester Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=NC2=CC=CC=C2C1NC(=O)C3=CC(=NC(=C3)Cl)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=NC2=CC=CC=C2C1NC(=O)C3=CC(=NC(=C3)Cl)OC

InChI

InChI=1S/C20H20ClN3O4/c1-20(2,3)28-19(26)17-16(12-7-5-6-8-13(12)22-17)24-18(25)11-9-14(21)23-15(10-11)27-4/h5-10,16H,1-4H3,(H,24,25)