N-[3-(dimethylamino)propyl]-4-methyl-2-nitro-3-phenylmethoxy-benzamide hydrochloride

Systemtic Name: N-[3-(dimethylamino)propyl]-4-methyl-2-nitro-3-phenylmethoxy-benzamide hydrochloride Openeye Name: 3-benzyloxy-N-[3-(dimethylamino)propyl]-4-methyl-2-nitro-benzamide hydrochloride CAS Name: N-[3-(dimethylamino)propyl]-4-methyl-2-nitro-3-phenylmethoxybenzamide hydrochloride IUPAC Name: N-[3-(dimethylamino)propyl]-4-methyl-2-nitro-3-phenylmethoxybenzamide hydrochloride Traditional Name: 3-benzoxy-N-[3-(dimethylamino)propyl]-4-methyl-2-nitro-benzamide hydrochloride Formula: C20H26ClN3O4 MolecularWeight: 407.89114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)NCCCN(C)C)[N+](=O)[O-])OCC2=CC=CC=C2.Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)NCCCN(C)C)[N+](=O)[O-])OCC2=CC=CC=C2.Cl

InChI

InChI=1S/C20H25N3O4.ClH/c1-15-10-11-17(20(24)21-12-7-13-22(2)3)18(23(25)26)19(15)27-14-16-8-5-4-6-9-16;/h4-6,8-11H,7,12-14H2,1-3H3,(H,21,24);1H