(2R)-6-butanoyl-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-2-propan-2-yl-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-butanoyl-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2R)-6-butanoyl-2-isopropyl-4-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1,4-benzoxazin-3-one CAS Name: (2R)-6-(1-oxobutyl)-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-butanoyl-4-(2-oxo-2-pyrrolidin-1-ylethyl)-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-butyryl-2-isopropyl-4-(2-keto-2-pyrrolidino-ethyl)-1,4-benzoxazin-3-one Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)N3CCCC3)C(C)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)N3CCCC3)C(C)C

InChI

InChI=1S/C21H28N2O4/c1-4-7-17(24)15-8-9-18-16(12-15)23(21(26)20(27-18)14(2)3)13-19(25)22-10-5-6-11-22/h8-9,12,14,20H,4-7,10-11,13H2,1-3H3/t20-/m1/s1