7-(4-chloranyl-3-methyl-phenyl)-3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]chromen-4-one

Systemtic Name: 7-(4-chloranyl-3-methyl-phenyl)-3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]chromen-4-one Openeye Name: 7-(4-chloro-3-methyl-phenyl)-3-[6-[3-(dimethylamino)pyrrolidin-1-yl]-3-pyridyl]chromen-4-one CAS Name: 7-(4-chloro-3-methylphenyl)-3-[6-[3-(dimethylamino)-1-pyrrolidinyl]-3-pyridinyl]-1-benzopyran-4-one IUPAC Name: 7-(4-chloro-3-methylphenyl)-3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]chromen-4-one Traditional Name: 7-(4-chloro-3-methyl-phenyl)-3-[6-[3-(dimethylamino)pyrrolidino]-3-pyridyl]chromone Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)C(=CO3)C4=CN=C(C=C4)N5CCC(C5)N(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)C(=CO3)C4=CN=C(C=C4)N5CCC(C5)N(C)C)Cl

InChI

InChI=1S/C27H26ClN3O2/c1-17-12-18(5-8-24(17)28)19-4-7-22-25(13-19)33-16-23(27(22)32)20-6-9-26(29-14-20)31-11-10-21(15-31)30(2)3/h4-9,12-14,16,21H,10-11,15H2,1-3H3