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

Systemtic Name: N-methyl-2-[4-nitro-2-[(propan-2-ylamino)methyl]phenoxy]propanamide Openeye Name: 2-[2-[(isopropylamino)methyl]-4-nitro-phenoxy]-N-methyl-propanamide CAS Name: N-methyl-2-[4-nitro-2-[(propan-2-ylamino)methyl]phenoxy]propanamide IUPAC Name: N-methyl-2-[4-nitro-2-[(propan-2-ylamino)methyl]phenoxy]propanamide Traditional Name: 2-[2-[(isopropylamino)methyl]-4-nitro-phenoxy]-N-methyl-propionamide Formula: C14H21N3O4 MolecularWeight: 295.33424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O4/c1-9(2)16-8-11-7-12(17(19)20)5-6-13(11)21-10(3)14(18)15-4/h5-7,9-10,16H,8H2,1-4H3,(H,15,18)