tert-butyl N-[1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-[1-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[4-(coumaran-5-ylmethyl)piperazino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C27H35N3O4 MolecularWeight: 465.5845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C27H35N3O4/c1-27(2,3)34-26(32)28-23(18-20-7-5-4-6-8-20)25(31)30-14-12-29(13-15-30)19-21-9-10-24-22(17-21)11-16-33-24/h4-10,17,23H,11-16,18-19H2,1-3H3,(H,28,32)