tert-butyl 4-[1-(phenylmethyl)indol-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(phenylmethyl)indol-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(1-benzylindole-2-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo-[1-(phenylmethyl)-2-indolyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-benzylindole-2-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1-benzylindole-2-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O3/c1-25(2,3)31-24(30)27-15-13-26(14-16-27)23(29)22-17-20-11-7-8-12-21(20)28(22)18-19-9-5-4-6-10-19/h4-12,17H,13-16,18H2,1-3H3