4-[[1-(1-benzofuran-5-ylmethyl)piperidin-4-yl]amino]-1-methyl-6-propan-2-yl-quinolin-2-one

Systemtic Name: 4-[[1-(1-benzofuran-5-ylmethyl)piperidin-4-yl]amino]-1-methyl-6-propan-2-yl-quinolin-2-one Openeye Name: 4-[[1-(benzofuran-5-ylmethyl)-4-piperidyl]amino]-6-isopropyl-1-methyl-quinolin-2-one CAS Name: 4-[[1-(5-benzofuranylmethyl)-4-piperidinyl]amino]-1-methyl-6-propan-2-yl-2-quinolinone IUPAC Name: 4-[[1-(1-benzofuran-5-ylmethyl)piperidin-4-yl]amino]-1-methyl-6-propan-2-ylquinolin-2-one Traditional Name: 4-[[1-(benzofuran-5-ylmethyl)-4-piperidyl]amino]-6-isopropyl-1-methyl-carbostyril Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=O)C=C2NC3CCN(CC3)CC4=CC5=C(C=C4)OC=C5)C

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=O)C=C2NC3CCN(CC3)CC4=CC5=C(C=C4)OC=C5)C

InChI

InChI=1S/C27H31N3O2/c1-18(2)20-5-6-25-23(15-20)24(16-27(31)29(25)3)28-22-8-11-30(12-9-22)17-19-4-7-26-21(14-19)10-13-32-26/h4-7,10,13-16,18,22,28H,8-9,11-12,17H2,1-3H3