methyl-[(2R)-1-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]amino]-1-oxidanylidene-hexan-2-yl]azanium

Systemtic Name: methyl-[(2R)-1-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]amino]-1-oxidanylidene-hexan-2-yl]azanium Openeye Name: methyl-[(1R)-1-[[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]carbamoyl]pentyl]ammonium CAS Name: methyl-[(2R)-1-[[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]amino]-1-oxohexan-2-yl]ammonium IUPAC Name: methyl-[(2R)-1-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]amino]-1-oxohexan-2-yl]azanium Traditional Name: methyl-[(1R)-1-[[(2R)-2-methylcoumaran-5-yl]carbamoyl]pentyl]ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=CC2=C(C=C1)OC(C2)C)[NH2+]C

Isomeric SMILES

CCCC[C@H](C(=O)NC1=CC2=C(C=C1)O[C@@H](C2)C)[NH2+]C

InChI

InChI=1S/C16H24N2O2/c1-4-5-6-14(17-3)16(19)18-13-7-8-15-12(10-13)9-11(2)20-15/h7-8,10-11,14,17H,4-6,9H2,1-3H3,(H,18,19)/p+1/t11-,14-/m1/s1