4-[4-(1-azanylethyl)-2-methoxy-5-nitro-phenoxy]-N-methyl-butanamide

Systemtic Name: 4-[4-(1-azanylethyl)-2-methoxy-5-nitro-phenoxy]-N-methyl-butanamide Openeye Name: 4-[4-(1-aminoethyl)-2-methoxy-5-nitro-phenoxy]-N-methyl-butanamide CAS Name: 4-[4-(1-aminoethyl)-2-methoxy-5-nitrophenoxy]-N-methylbutanamide IUPAC Name: 4-[4-(1-aminoethyl)-2-methoxy-5-nitrophenoxy]-N-methylbutanamide Traditional Name: 4-[4-(1-aminoethyl)-2-methoxy-5-nitro-phenoxy]-N-methyl-butyramide Formula: C14H21N3O5 MolecularWeight: 311.33364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O5/c1-9(15)10-7-12(21-3)13(8-11(10)17(19)20)22-6-4-5-14(18)16-2/h7-9H,4-6,15H2,1-3H3,(H,16,18)