3-[8-chloranyl-1-cyclopropyl-6-fluoranyl-7-[3-(methylaminomethyl)-2,5-dihydropyrrol-1-yl]-4-oxidanylidene-quinolin-3-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[8-chloranyl-1-cyclopropyl-6-fluoranyl-7-[3-(methylaminomethyl)-2,5-dihydropyrrol-1-yl]-4-oxidanylidene-quinolin-3-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[8-chloro-1-cyclopropyl-6-fluoro-7-[3-(methylaminomethyl)-2,5-dihydropyrrol-1-yl]-4-oxo-3-quinolyl]-3-oxo-propanenitrile CAS Name: 3-[8-chloro-1-cyclopropyl-6-fluoro-7-[3-(methylaminomethyl)-2,5-dihydropyrrol-1-yl]-4-oxo-3-quinolinyl]-3-oxopropanenitrile IUPAC Name: 3-[8-chloro-1-cyclopropyl-6-fluoro-7-[3-(methylaminomethyl)-2,5-dihydropyrrol-1-yl]-4-oxoquinolin-3-yl]-3-oxopropanenitrile Traditional Name: 3-[8-chloro-1-cyclopropyl-6-fluoro-4-keto-7-[3-(methylaminomethyl)-3-pyrrolin-1-yl]-3-quinolyl]-3-keto-propionitrile Formula: C21H20ClFN4O2 MolecularWeight: 414.860503

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CCN(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)CC#N)C4CC4)F

Isomeric SMILES

CNCC1=CCN(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)CC#N)C4CC4)F

InChI

InChI=1S/C21H20ClFN4O2/c1-25-9-12-5-7-26(10-12)20-16(23)8-14-19(18(20)22)27(13-2-3-13)11-15(21(14)29)17(28)4-6-24/h5,8,11,13,25H,2-4,7,9-10H2,1H3