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N-[3-cyano-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-2-methyl-propanamide; ethanedioic acid

N-[3-cyano-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-2-methyl-propanamide; ethanedioic acid

Systemtic Name:N-[3-cyano-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-2-methyl-propanamide; ethanedioic acid
Openeye Name:N-[3-cyano-2-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-2-methyl-propanamide; oxalic acid
CAS Name:N-[3-cyano-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-methylpropanamide; oxalic acid
IUPAC Name:N-[3-cyano-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-methylpropanamide; oxalic acid
Traditional Name:N-[3-cyano-2-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-2-methyl-propionamide; oxalic acid
Formula: C19H27N3O7
MolecularWeight: 409.43358
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1OCC(CNC(C)C)O)C#N.C(=O)(C(=O)O)O


Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1OCC(CNC(C)C)O)C#N.C(=O)(C(=O)O)O


InChI

InChI=1S/C17H25N3O3.C2H2O4/c1-11(2)17(22)20-15-7-5-6-13(8-18)16(15)23-10-14(21)9-19-12(3)4;3-1(4)2(5)6/h5-7,11-12,14,19,21H,9-10H2,1-4H3,(H,20,22);(H,3,4)(H,5,6)


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