ethyl 3-[2-[(4-tert-butylphenyl)methylamino]-2-oxidanylidene-ethyl]benzimidazole-4-carboxylate

Systemtic Name: ethyl 3-[2-[(4-tert-butylphenyl)methylamino]-2-oxidanylidene-ethyl]benzimidazole-4-carboxylate Openeye Name: ethyl 3-[2-[(4-tert-butylphenyl)methylamino]-2-oxo-ethyl]benzimidazole-4-carboxylate CAS Name: 3-[2-[(4-tert-butylphenyl)methylamino]-2-oxoethyl]-4-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-[(4-tert-butylphenyl)methylamino]-2-oxoethyl]benzimidazole-4-carboxylate Traditional Name: 3-[2-[(4-tert-butylbenzyl)amino]-2-keto-ethyl]benzimidazole-4-carboxylic acid ethyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC=C1)N=CN2CC(=O)NCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C2C(=CC=C1)N=CN2CC(=O)NCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H27N3O3/c1-5-29-22(28)18-7-6-8-19-21(18)26(15-25-19)14-20(27)24-13-16-9-11-17(12-10-16)23(2,3)4/h6-12,15H,5,13-14H2,1-4H3,(H,24,27)