butyl 2-methylprop-2-enoate; ethenylbenzene; (E)-2-methylbut-2-enoate; (Z)-2-methyl-5-oxidanyl-pent-2-enoate

Systemtic Name: butyl 2-methylprop-2-enoate; ethenylbenzene; (E)-2-methylbut-2-enoate; (Z)-2-methyl-5-oxidanyl-pent-2-enoate Openeye Name: butyl 2-methylprop-2-enoate; (Z)-5-hydroxy-2-methyl-pent-2-enoate; (E)-2-methylbut-2-enoate; styrene CAS Name: (Z)-5-hydroxy-2-methyl-2-pentenoate; (E)-2-methyl-2-butenoate; 2-methyl-2-propenoic acid butyl ester; styrene IUPAC Name: butyl 2-methylprop-2-enoate; (Z)-5-hydroxy-2-methylpent-2-enoate; (E)-2-methylbut-2-enoate; styrene Traditional Name: (Z)-5-hydroxy-2-methyl-pent-2-enoate; 2-methylacrylic acid butyl ester; (E)-2-methylbut-2-enoate; styrene Formula: C27H38O7-2 MolecularWeight: 474.58642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=C)C.CC=C(C)C(=O)[O-].CC(=CCCO)C(=O)[O-].C=CC1=CC=CC=C1

Isomeric SMILES

CCCCOC(=O)C(=C)C.C/C=C(\C)/C(=O)[O-].C/C(=C/CCO)/C(=O)[O-].C=CC1=CC=CC=C1

InChI

InChI=1S/C8H14O2.C8H8.C6H10O3.C5H8O2/c1-4-5-6-10-8(9)7(2)3;1-2-8-6-4-3-5-7-8;1-5(6(8)9)3-2-4-7;1-3-4(2)5(6)7/h2,4-6H2,1,3H3;2-7H,1H2;3,7H,2,4H2,1H3,(H,8,9);3H,1-2H3,(H,6,7)/p-2/b;;5-3-;4-3+