tert-butyl N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-N-[4-[(3-nitrophenyl)sulfonylamino]butyl]carbamate

Systemtic Name: tert-butyl N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-N-[4-[(3-nitrophenyl)sulfonylamino]butyl]carbamate Openeye Name: tert-butyl N-(2,3-dihydrobenzofuran-2-ylmethyl)-N-[4-[(3-nitrophenyl)sulfonylamino]butyl]carbamate CAS Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-N-[4-[(3-nitrophenyl)sulfonylamino]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-N-[4-[(3-nitrophenyl)sulfonylamino]butyl]carbamate Traditional Name: N-(coumaran-2-ylmethyl)-N-[4-[(3-nitrophenyl)sulfonylamino]butyl]carbamic acid tert-butyl ester Formula: C24H31N3O7S MolecularWeight: 505.58384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCCNS(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-])CC2CC3=CC=CC=C3O2

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCCNS(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-])CC2CC3=CC=CC=C3O2

InChI

InChI=1S/C24H31N3O7S/c1-24(2,3)34-23(28)26(17-20-15-18-9-4-5-12-22(18)33-20)14-7-6-13-25-35(31,32)21-11-8-10-19(16-21)27(29)30/h4-5,8-12,16,20,25H,6-7,13-15,17H2,1-3H3