(2S)-2-[2-[[(2S)-1-oxidanylbutan-2-yl]amino]ethylamino]butan-1-ol; (E)-3-phenylprop-2-enoic acid

Systemtic Name: (2S)-2-[2-[[(2S)-1-oxidanylbutan-2-yl]amino]ethylamino]butan-1-ol; (E)-3-phenylprop-2-enoic acid Openeye Name: (2S)-2-[2-[[(1S)-1-(hydroxymethyl)propyl]amino]ethylamino]butan-1-ol; (E)-3-phenylprop-2-enoic acid CAS Name: (2S)-2-[2-[[(2S)-1-hydroxybutan-2-yl]amino]ethylamino]-1-butanol; (E)-3-phenyl-2-propenoic acid IUPAC Name: (2S)-2-[2-[[(2S)-1-hydroxybutan-2-yl]amino]ethylamino]butan-1-ol; (E)-3-phenylprop-2-enoic acid Traditional Name: (2S)-2-[2-[[(1S)-1-methylolpropyl]amino]ethylamino]butan-1-ol; (E)-3-phenylacrylic acid Formula: C19H32N2O4 MolecularWeight: 352.46838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCCNC(CC)CO.C1=CC=C(C=C1)C=CC(=O)O

Isomeric SMILES

CC[C@@H](CO)NCCN[C@@H](CC)CO.C1=CC=C(C=C1)/C=C/C(=O)O

InChI

InChI=1S/C10H24N2O2.C9H8O2/c1-3-9(7-13)11-5-6-12-10(4-2)8-14;10-9(11)7-6-8-4-2-1-3-5-8/h9-14H,3-8H2,1-2H3;1-7H,(H,10,11)/b;7-6+/t9-,10-;/m0./s1