N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-3-nitro-4-phenylazanyl-benzamide

Systemtic Name: N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-3-nitro-4-phenylazanyl-benzamide Openeye Name: 4-anilino-N-[(4-isobutylmorpholin-2-yl)methyl]-3-nitro-benzamide CAS Name: 4-anilino-N-[[4-(2-methylpropyl)-2-morpholinyl]methyl]-3-nitrobenzamide IUPAC Name: 4-anilino-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-3-nitrobenzamide Traditional Name: 4-anilino-N-[(4-isobutylmorpholin-2-yl)methyl]-3-nitro-benzamide Formula: C22H28N4O4 MolecularWeight: 412.48212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCOC(C1)CNC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1CCOC(C1)CNC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O4/c1-16(2)14-25-10-11-30-19(15-25)13-23-22(27)17-8-9-20(21(12-17)26(28)29)24-18-6-4-3-5-7-18/h3-9,12,16,19,24H,10-11,13-15H2,1-2H3,(H,23,27)