(E)-3-azanyl-N-ethyl-2-methyl-but-2-enamide; (Z)-3-(dimethylamino)-2-methyl-hex-2-enoic acid

Systemtic Name: (E)-3-azanyl-N-ethyl-2-methyl-but-2-enamide; (Z)-3-(dimethylamino)-2-methyl-hex-2-enoic acid Openeye Name: (E)-3-amino-N-ethyl-2-methyl-but-2-enamide; (Z)-3-(dimethylamino)-2-methyl-hex-2-enoic acid CAS Name: (E)-3-amino-N-ethyl-2-methyl-2-butenamide; (Z)-3-(dimethylamino)-2-methyl-2-hexenoic acid IUPAC Name: (E)-3-amino-N-ethyl-2-methylbut-2-enamide; (Z)-3-(dimethylamino)-2-methylhex-2-enoic acid Traditional Name: (E)-3-amino-N-ethyl-2-methyl-but-2-enamide; (Z)-3-(dimethylamino)-2-methyl-hex-2-enoic acid Formula: C16H31N3O3 MolecularWeight: 313.43564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(C)C(=O)O)N(C)C.CCNC(=O)C(=C(C)N)C

Isomeric SMILES

CCC/C(=C(\C)/C(=O)O)/N(C)C.CCNC(=O)/C(=C(\C)/N)/C

InChI

InChI=1S/C9H17NO2.C7H14N2O/c1-5-6-8(10(3)4)7(2)9(11)12;1-4-9-7(10)5(2)6(3)8/h5-6H2,1-4H3,(H,11,12);4,8H2,1-3H3,(H,9,10)/b8-7-;6-5+