2-[3-[(6-chloranyl-8-iodanyl-3,4-dihydro-2H-chromen-4-yl)amino]propylamino]-1H-quinolin-4-one hydrochloride

Systemtic Name: 2-[3-[(6-chloranyl-8-iodanyl-3,4-dihydro-2H-chromen-4-yl)amino]propylamino]-1H-quinolin-4-one hydrochloride Openeye Name: 2-[3-[(6-chloro-8-iodo-chroman-4-yl)amino]propylamino]-1H-quinolin-4-one hydrochloride CAS Name: 2-[3-[(6-chloro-8-iodo-3,4-dihydro-2H-1-benzopyran-4-yl)amino]propylamino]-1H-quinolin-4-one hydrochloride IUPAC Name: 2-[3-[(6-chloro-8-iodo-3,4-dihydro-2H-chromen-4-yl)amino]propylamino]-1H-quinolin-4-one hydrochloride Traditional Name: 2-[3-[(6-chloro-8-iodo-chroman-4-yl)amino]propylamino]-4-quinolone hydrochloride Formula: C21H22Cl2IN3O2 MolecularWeight: 546.22875

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2C1NCCCNC3=CC(=O)C4=CC=CC=C4N3)Cl)I.Cl

Isomeric SMILES

C1COC2=C(C=C(C=C2C1NCCCNC3=CC(=O)C4=CC=CC=C4N3)Cl)I.Cl

InChI

InChI=1S/C21H21ClIN3O2.ClH/c22-13-10-15-17(6-9-28-21(15)16(23)11-13)24-7-3-8-25-20-12-19(27)14-4-1-2-5-18(14)26-20;/h1-2,4-5,10-12,17,24H,3,6-9H2,(H2,25,26,27);1H