4-azanyl-N-[4-[2-methyl-2-[[2-oxidanyl-2-(6-oxidanyl-3-oxidanylidene-4H-1,4-benzoxazin-8-yl)ethyl]amino]propyl]phenyl]butanamide

Systemtic Name: 4-azanyl-N-[4-[2-methyl-2-[[2-oxidanyl-2-(6-oxidanyl-3-oxidanylidene-4H-1,4-benzoxazin-8-yl)ethyl]amino]propyl]phenyl]butanamide Openeye Name: 4-amino-N-[4-[2-[[2-hydroxy-2-(6-hydroxy-3-oxo-4H-1,4-benzoxazin-8-yl)ethyl]amino]-2-methyl-propyl]phenyl]butanamide CAS Name: 4-amino-N-[4-[2-[[2-hydroxy-2-(6-hydroxy-3-oxo-4H-1,4-benzoxazin-8-yl)ethyl]amino]-2-methylpropyl]phenyl]butanamide IUPAC Name: 4-amino-N-[4-[2-[[2-hydroxy-2-(6-hydroxy-3-oxo-4H-1,4-benzoxazin-8-yl)ethyl]amino]-2-methylpropyl]phenyl]butanamide Traditional Name: 4-amino-N-[4-[2-[[2-hydroxy-2-(6-hydroxy-3-keto-4H-1,4-benzoxazin-8-yl)ethyl]amino]-2-methyl-propyl]phenyl]butyramide Formula: C24H32N4O5 MolecularWeight: 456.53468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)NC(=O)CCCN)NCC(C2=CC(=CC3=C2OCC(=O)N3)O)O

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)NC(=O)CCCN)NCC(C2=CC(=CC3=C2OCC(=O)N3)O)O

InChI

InChI=1S/C24H32N4O5/c1-24(2,12-15-5-7-16(8-6-15)27-21(31)4-3-9-25)26-13-20(30)18-10-17(29)11-19-23(18)33-14-22(32)28-19/h5-8,10-11,20,26,29-30H,3-4,9,12-14,25H2,1-2H3,(H,27,31)(H,28,32)