N-(2-diethylaminoethyl)-4-methyl-2-nitro-3-phenylmethoxy-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-methyl-2-nitro-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-(2-diethylaminoethyl)-4-methyl-2-nitro-benzamide CAS Name: N-(2-diethylaminoethyl)-4-methyl-2-nitro-3-phenylmethoxybenzamide IUPAC Name: N-(2-diethylaminoethyl)-4-methyl-2-nitro-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-(2-diethylaminoethyl)-4-methyl-2-nitro-benzamide Formula: C21H27N3O4 MolecularWeight: 385.45678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C(=C(C=C1)C)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C(=C(C=C1)C)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O4/c1-4-23(5-2)14-13-22-21(25)18-12-11-16(3)20(19(18)24(26)27)28-15-17-9-7-6-8-10-17/h6-12H,4-5,13-15H2,1-3H3,(H,22,25)