2-[2-nitro-4-[(propan-2-ylamino)methyl]phenoxy]ethanamide

Systemtic Name: 2-[2-nitro-4-[(propan-2-ylamino)methyl]phenoxy]ethanamide Openeye Name: 2-[4-[(isopropylamino)methyl]-2-nitro-phenoxy]acetamide CAS Name: 2-[2-nitro-4-[(propan-2-ylamino)methyl]phenoxy]acetamide IUPAC Name: 2-[2-nitro-4-[(propan-2-ylamino)methyl]phenoxy]acetamide Traditional Name: 2-[4-[(isopropylamino)methyl]-2-nitro-phenoxy]acetamide Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC1=CC(=C(C=C1)OCC(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)NCC1=CC(=C(C=C1)OCC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4/c1-8(2)14-6-9-3-4-11(19-7-12(13)16)10(5-9)15(17)18/h3-5,8,14H,6-7H2,1-2H3,(H2,13,16)