tert-butyl 4-(1-prop-2-enylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-(1-prop-2-enylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(1-allylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate CAS Name: 4-(1-prop-2-enyl-2-benzimidazolyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-prop-2-enylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(1-allylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3N2CC=C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3N2CC=C

InChI

InChI=1S/C20H28N4O2/c1-5-11-24-17-10-7-6-9-16(17)21-18(24)22-12-8-13-23(15-14-22)19(25)26-20(2,3)4/h5-7,9-10H,1,8,11-15H2,2-4H3