ethyl 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]-3H-benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]-3H-benzimidazole-5-carboxylate Openeye Name: ethyl 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]-3H-benzimidazole-5-carboxylate CAS Name: 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]-3H-benzimidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]-3H-benzimidazole-5-carboxylate Traditional Name: 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]-3H-benzimidazole-5-carboxylic acid ethyl ester Formula: C16H21N3O4 MolecularWeight: 319.35564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(N2)NCC3COC(O3)(C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(N2)NCC3COC(O3)(C)C

InChI

InChI=1S/C16H21N3O4/c1-4-21-14(20)10-5-6-12-13(7-10)19-15(18-12)17-8-11-9-22-16(2,3)23-11/h5-7,11H,4,8-9H2,1-3H3,(H2,17,18,19)