N-[3-ethanoyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]butanamide azide

Systemtic Name: N-[3-ethanoyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]butanamide azide Openeye Name: N-[3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]butanamide azide CAS Name: N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]butanamide azide IUPAC Name: N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]butanamide azide Traditional Name: N-[3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]butyramide azide Formula: C18H28N5O4- MolecularWeight: 378.44602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)C)O)C(=O)C.[N-]=[N+]=[N-]

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)C)O)C(=O)C.[N-]=[N+]=[N-]

InChI

InChI=1S/C18H28N2O4.N3/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3;1-3-2/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23);/q;-1