butyl N-[4-[(2,3-dihydro-1-benzofuran-7-ylcarbonylamino)methyl]-4-phenyl-cyclohexyl]carbamate

Systemtic Name: butyl N-[4-[(2,3-dihydro-1-benzofuran-7-ylcarbonylamino)methyl]-4-phenyl-cyclohexyl]carbamate Openeye Name: butyl N-[4-[(2,3-dihydrobenzofuran-7-carbonylamino)methyl]-4-phenyl-cyclohexyl]carbamate CAS Name: N-[4-[[[2,3-dihydrobenzofuran-7-yl(oxo)methyl]amino]methyl]-4-phenylcyclohexyl]carbamic acid butyl ester IUPAC Name: butyl N-[4-[(2,3-dihydro-1-benzofuran-7-carbonylamino)methyl]-4-phenylcyclohexyl]carbamate Traditional Name: N-[4-[(coumaran-7-carbonylamino)methyl]-4-phenyl-cyclohexyl]carbamic acid butyl ester Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1CCC(CC1)(CNC(=O)C2=C3C(=CC=C2)CCO3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)NC1CCC(CC1)(CNC(=O)C2=C3C(=CC=C2)CCO3)C4=CC=CC=C4

InChI

InChI=1S/C27H34N2O4/c1-2-3-17-33-26(31)29-22-12-15-27(16-13-22,21-9-5-4-6-10-21)19-28-25(30)23-11-7-8-20-14-18-32-24(20)23/h4-11,22H,2-3,12-19H2,1H3,(H,28,30)(H,29,31)