6-[1-ethanoyl-3-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[1-ethanoyl-3-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[1-acetyl-3-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-acetyl-3-(1-pyrrolidinylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[1-acetyl-3-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[1-acetyl-3-(pyrrolidinomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4H-1,4-benzoxazin-3-one Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C2=CC=CC=C2CC(N1C3=CC4=C(C=C3)OCC(=O)N4)CN5CCCC5

Isomeric SMILES

CC(=O)C1C2=CC=CC=C2CC(N1C3=CC4=C(C=C3)OCC(=O)N4)CN5CCCC5

InChI

InChI=1S/C24H27N3O3/c1-16(28)24-20-7-3-2-6-17(20)12-19(14-26-10-4-5-11-26)27(24)18-8-9-22-21(13-18)25-23(29)15-30-22/h2-3,6-9,13,19,24H,4-5,10-12,14-15H2,1H3,(H,25,29)