2-[4-(aminomethyl)-2-nitro-phenoxy]-N-butan-2-yl-propanamide

Systemtic Name: 2-[4-(aminomethyl)-2-nitro-phenoxy]-N-butan-2-yl-propanamide Openeye Name: 2-[4-(aminomethyl)-2-nitro-phenoxy]-N-sec-butyl-propanamide CAS Name: 2-[4-(aminomethyl)-2-nitrophenoxy]-N-butan-2-ylpropanamide IUPAC Name: 2-[4-(aminomethyl)-2-nitrophenoxy]-N-butan-2-ylpropanamide Traditional Name: 2-[4-(aminomethyl)-2-nitro-phenoxy]-N-sec-butyl-propionamide Formula: C14H21N3O4 MolecularWeight: 295.33424

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(C)OC1=C(C=C(C=C1)CN)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)C(C)OC1=C(C=C(C=C1)CN)[N+](=O)[O-]

InChI

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