[2-[3-(2-dimethylaminoethyl)-4-nitro-phenyl]-1H-benzimidazol-4-yl] carbamate

Systemtic Name: [2-[3-(2-dimethylaminoethyl)-4-nitro-phenyl]-1H-benzimidazol-4-yl] carbamate Openeye Name: [2-[3-(2-dimethylaminoethyl)-4-nitro-phenyl]-1H-benzimidazol-4-yl] carbamate CAS Name: carbamic acid [2-[3-(2-dimethylaminoethyl)-4-nitrophenyl]-1H-benzimidazol-4-yl] ester IUPAC Name: [2-[3-(2-dimethylaminoethyl)-4-nitrophenyl]-1H-benzimidazol-4-yl] carbamate Traditional Name: carbamic acid [2-[3-(2-dimethylaminoethyl)-4-nitro-phenyl]-1H-benzimidazol-4-yl] ester Formula: C18H19N5O4 MolecularWeight: 369.37456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=C(C=CC(=C1)C2=NC3=C(N2)C=CC=C3OC(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCC1=C(C=CC(=C1)C2=NC3=C(N2)C=CC=C3OC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4/c1-22(2)9-8-11-10-12(6-7-14(11)23(25)26)17-20-13-4-3-5-15(16(13)21-17)27-18(19)24/h3-7,10H,8-9H2,1-2H3,(H2,19,24)(H,20,21)