(1R,2R)-2-[2-chloranyl-4-[3-[3-(cyclopropylcarbamoyl)-4-oxidanylidene-1,8-naphthyridin-1-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid

Systemtic Name: (1R,2R)-2-[2-chloranyl-4-[3-[3-(cyclopropylcarbamoyl)-4-oxidanylidene-1,8-naphthyridin-1-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid Openeye Name: (1R,2R)-2-[2-chloro-4-[3-[3-(cyclopropylcarbamoyl)-4-oxo-1,8-naphthyridin-1-yl]phenyl]phenyl]cyclopropanecarboxylic acid CAS Name: (1R,2R)-2-[2-chloro-4-[3-[3-[(cyclopropylamino)-oxomethyl]-4-oxo-1,8-naphthyridin-1-yl]phenyl]phenyl]-1-cyclopropanecarboxylic acid IUPAC Name: (1R,2R)-2-[2-chloro-4-[3-[3-(cyclopropylcarbamoyl)-4-oxo-1,8-naphthyridin-1-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid Traditional Name: (1R,2R)-2-[2-chloro-4-[3-[3-(cyclopropylcarbamoyl)-4-keto-1,8-naphthyridin-1-yl]phenyl]phenyl]cyclopropanecarboxylic acid Formula: C28H22ClN3O4 MolecularWeight: 499.94498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CN(C3=C(C2=O)C=CC=N3)C4=CC=CC(=C4)C5=CC(=C(C=C5)C6CC6C(=O)O)Cl

Isomeric SMILES

C1CC1NC(=O)C2=CN(C3=C(C2=O)C=CC=N3)C4=CC=CC(=C4)C5=CC(=C(C=C5)[C@@H]6C[C@H]6C(=O)O)Cl

InChI

InChI=1S/C28H22ClN3O4/c29-24-12-16(6-9-19(24)21-13-22(21)28(35)36)15-3-1-4-18(11-15)32-14-23(27(34)31-17-7-8-17)25(33)20-5-2-10-30-26(20)32/h1-6,9-12,14,17,21-22H,7-8,13H2,(H,31,34)(H,35,36)/t21-,22+/m0/s1