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

Systemtic Name: (E)-3-azanyl-2-methyl-N-propyl-but-2-enamide; (Z)-3-(dimethylamino)-2-methyl-pent-2-enoic acid Openeye Name: (E)-3-amino-2-methyl-N-propyl-but-2-enamide; (Z)-3-(dimethylamino)-2-methyl-pent-2-enoic acid CAS Name: (E)-3-amino-2-methyl-N-propyl-2-butenamide; (Z)-3-(dimethylamino)-2-methyl-2-pentenoic acid IUPAC Name: (E)-3-amino-2-methyl-N-propylbut-2-enamide; (Z)-3-(dimethylamino)-2-methylpent-2-enoic acid Traditional Name: (E)-3-amino-2-methyl-N-propyl-but-2-enamide; (Z)-3-(dimethylamino)-2-methyl-pent-2-enoic acid Formula: C16H31N3O3 MolecularWeight: 313.43564

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(=C(C)N)C.CCC(=C(C)C(=O)O)N(C)C

Isomeric SMILES

CCCNC(=O)/C(=C(\C)/N)/C.CC/C(=C(\C)/C(=O)O)/N(C)C

InChI

InChI=1S/C8H16N2O.C8H15NO2/c1-4-5-10-8(11)6(2)7(3)9;1-5-7(9(3)4)6(2)8(10)11/h4-5,9H2,1-3H3,(H,10,11);5H2,1-4H3,(H,10,11)/b7-6+;7-6-