3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-methoxy-2-methyl-phenyl)chromen-4-one

Systemtic Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-methoxy-2-methyl-phenyl)chromen-4-one Openeye Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]-3-pyridyl]-7-(4-methoxy-2-methyl-phenyl)chromen-4-one CAS Name: 3-[6-[3-(dimethylamino)-1-pyrrolidinyl]-3-pyridinyl]-7-(4-methoxy-2-methylphenyl)-1-benzopyran-4-one IUPAC Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-methoxy-2-methylphenyl)chromen-4-one Traditional Name: 3-[6-[3-(dimethylamino)pyrrolidino]-3-pyridyl]-7-(4-methoxy-2-methyl-phenyl)chromone Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N3O3/c1-18-13-22(33-4)7-9-23(18)19-5-8-24-26(14-19)34-17-25(28(24)32)20-6-10-27(29-15-20)31-12-11-21(16-31)30(2)3/h5-10,13-15,17,21H,11-12,16H2,1-4H3