2-acetamidoethyl-[(3S,5S)-5-methylheptan-3-yl]azanium

Systemtic Name: 2-acetamidoethyl-[(3S,5S)-5-methylheptan-3-yl]azanium Openeye Name: 2-acetamidoethyl-[(1S,3S)-1-ethyl-3-methyl-pentyl]ammonium CAS Name: 2-acetamidoethyl-[(3S,5S)-5-methylheptan-3-yl]ammonium IUPAC Name: 2-acetamidoethyl-[(3S,5S)-5-methylheptan-3-yl]azanium Traditional Name: 2-acetamidoethyl-[(1S,3S)-1-ethyl-3-methyl-pentyl]ammonium Formula: C12H27N2O+ MolecularWeight: 215.35558

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]CCNC(=O)C

Isomeric SMILES

CC[C@H](C)C[C@H](CC)[NH2+]CCNC(=O)C

InChI

InChI=1S/C12H26N2O/c1-5-10(3)9-12(6-2)14-8-7-13-11(4)15/h10,12,14H,5-9H2,1-4H3,(H,13,15)/p+1/t10-,12-/m0/s1