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

Systemtic Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-ethylphenyl)chromen-4-one Openeye Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]-3-pyridyl]-7-(4-ethylphenyl)chromen-4-one CAS Name: 3-[6-[3-(dimethylamino)-1-pyrrolidinyl]-3-pyridinyl]-7-(4-ethylphenyl)-1-benzopyran-4-one IUPAC Name: 3-[6-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-7-(4-ethylphenyl)chromen-4-one Traditional Name: 3-[6-[3-(dimethylamino)pyrrolidino]-3-pyridyl]-7-(4-ethylphenyl)chromone Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC3=C(C=C2)C(=O)C(=CO3)C4=CN=C(C=C4)N5CCC(C5)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC3=C(C=C2)C(=O)C(=CO3)C4=CN=C(C=C4)N5CCC(C5)N(C)C

InChI

InChI=1S/C28H29N3O2/c1-4-19-5-7-20(8-6-19)21-9-11-24-26(15-21)33-18-25(28(24)32)22-10-12-27(29-16-22)31-14-13-23(17-31)30(2)3/h5-12,15-16,18,23H,4,13-14,17H2,1-3H3