(3S)-8-chloranyl-3-[3-(5-fluoranyl-1H-indol-3-yl)propylamino]-3,4-dihydro-2H-chromene-5-carboxamide

Systemtic Name: (3S)-8-chloranyl-3-[3-(5-fluoranyl-1H-indol-3-yl)propylamino]-3,4-dihydro-2H-chromene-5-carboxamide Openeye Name: (3S)-8-chloro-3-[3-(5-fluoro-1H-indol-3-yl)propylamino]chromane-5-carboxamide CAS Name: (3S)-8-chloro-3-[3-(5-fluoro-1H-indol-3-yl)propylamino]-3,4-dihydro-2H-1-benzopyran-5-carboxamide IUPAC Name: (3S)-8-chloro-3-[3-(5-fluoro-1H-indol-3-yl)propylamino]-3,4-dihydro-2H-chromene-5-carboxamide Traditional Name: (3S)-8-chloro-3-[3-(5-fluoro-1H-indol-3-yl)propylamino]chroman-5-carboxamide Formula: C21H21ClFN3O2 MolecularWeight: 401.861743

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C(C=CC(=C21)C(=O)N)Cl)NCCCC3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

C1[C@@H](COC2=C(C=CC(=C21)C(=O)N)Cl)NCCCC3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H21ClFN3O2/c22-18-5-4-15(21(24)27)17-9-14(11-28-20(17)18)25-7-1-2-12-10-26-19-6-3-13(23)8-16(12)19/h3-6,8,10,14,25-26H,1-2,7,9,11H2,(H2,24,27)/t14-/m0/s1