2-[5-bromanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]-1,8-naphthyridine-4-carboxylic acid

Systemtic Name: 2-[5-bromanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]-1,8-naphthyridine-4-carboxylic acid Openeye Name: 2-(5-bromo-1-tert-butoxycarbonyl-indol-3-yl)-1,8-naphthyridine-4-carboxylic acid CAS Name: 2-[5-bromo-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-indolyl]-1,8-naphthyridine-4-carboxylic acid IUPAC Name: 2-[5-bromo-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]-1,8-naphthyridine-4-carboxylic acid Traditional Name: 2-(5-bromo-1-tert-butoxycarbonyl-indol-3-yl)-1,8-naphthyridine-4-carboxylic acid Formula: C22H18BrN3O4 MolecularWeight: 468.30002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)Br)C3=NC4=C(C=CC=N4)C(=C3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)Br)C3=NC4=C(C=CC=N4)C(=C3)C(=O)O

InChI

InChI=1S/C22H18BrN3O4/c1-22(2,3)30-21(29)26-11-16(14-9-12(23)6-7-18(14)26)17-10-15(20(27)28)13-5-4-8-24-19(13)25-17/h4-11H,1-3H3,(H,27,28)