1-[4-[2-(1-methylbenzimidazol-2-yl)ethoxy]-3-nitro-phenyl]ethyl N-(2,4-dimethylphenyl)carbamate

Systemtic Name: 1-[4-[2-(1-methylbenzimidazol-2-yl)ethoxy]-3-nitro-phenyl]ethyl N-(2,4-dimethylphenyl)carbamate Openeye Name: 1-[4-[2-(1-methylbenzimidazol-2-yl)ethoxy]-3-nitro-phenyl]ethyl N-(2,4-dimethylphenyl)carbamate CAS Name: N-(2,4-dimethylphenyl)carbamic acid 1-[4-[2-(1-methyl-2-benzimidazolyl)ethoxy]-3-nitrophenyl]ethyl ester IUPAC Name: 1-[4-[2-(1-methylbenzimidazol-2-yl)ethoxy]-3-nitrophenyl]ethyl N-(2,4-dimethylphenyl)carbamate Traditional Name: N-(2,4-dimethylphenyl)carbamic acid 1-[4-[2-(1-methylbenzimidazol-2-yl)ethoxy]-3-nitro-phenyl]ethyl ester Formula: C27H28N4O5 MolecularWeight: 488.53502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)OC(C)C2=CC(=C(C=C2)OCCC3=NC4=CC=CC=C4N3C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)OC(C)C2=CC(=C(C=C2)OCCC3=NC4=CC=CC=C4N3C)[N+](=O)[O-])C

InChI

InChI=1S/C27H28N4O5/c1-17-9-11-21(18(2)15-17)29-27(32)36-19(3)20-10-12-25(24(16-20)31(33)34)35-14-13-26-28-22-7-5-6-8-23(22)30(26)4/h5-12,15-16,19H,13-14H2,1-4H3,(H,29,32)