3-azanyl-6,6-dimethyl-N-(3-nitropropyl)-4-oxidanyl-3-phenoxy-oct-7-ynamide

Systemtic Name: 3-azanyl-6,6-dimethyl-N-(3-nitropropyl)-4-oxidanyl-3-phenoxy-oct-7-ynamide Openeye Name: 3-amino-4-hydroxy-6,6-dimethyl-N-(3-nitropropyl)-3-phenoxy-oct-7-ynamide CAS Name: 3-amino-4-hydroxy-6,6-dimethyl-N-(3-nitropropyl)-3-phenoxy-7-octynamide IUPAC Name: 3-amino-4-hydroxy-6,6-dimethyl-N-(3-nitropropyl)-3-phenoxyoct-7-ynamide Traditional Name: 3-amino-4-hydroxy-6,6-dimethyl-N-(3-nitropropyl)-3-phenoxy-oct-7-ynamide Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C(CC(=O)NCCC[N+](=O)[O-])(N)OC1=CC=CC=C1)O)C#C

Isomeric SMILES

CC(C)(CC(C(CC(=O)NCCC[N+](=O)[O-])(N)OC1=CC=CC=C1)O)C#C

InChI

InChI=1S/C19H27N3O5/c1-4-18(2,3)13-16(23)19(20,27-15-9-6-5-7-10-15)14-17(24)21-11-8-12-22(25)26/h1,5-7,9-10,16,23H,8,11-14,20H2,2-3H3,(H,21,24)