butyl prop-2-enoate; ethenylbenzene; methyl 2-methylprop-2-enoate; prop-2-enyl 2-methylprop-2-enoate

Systemtic Name: butyl prop-2-enoate; ethenylbenzene; methyl 2-methylprop-2-enoate; prop-2-enyl 2-methylprop-2-enoate Openeye Name: allyl 2-methylprop-2-enoate; butyl prop-2-enoate; methyl 2-methylprop-2-enoate; styrene CAS Name: 2-methyl-2-propenoic acid methyl ester; 2-methyl-2-propenoic acid prop-2-enyl ester; 2-propenoic acid butyl ester; styrene IUPAC Name: butyl prop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enyl 2-methylprop-2-enoate; styrene Traditional Name: acrylic acid butyl ester; 2-methylacrylic acid allyl ester; 2-methylacrylic acid methyl ester; styrene Formula: C27H38O6 MolecularWeight: 458.58702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC=C.C=CC1=CC=CC=C1

Isomeric SMILES

CCCCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC=C.C=CC1=CC=CC=C1

InChI

InChI=1S/C8H8.C7H10O2.C7H12O2.C5H8O2/c1-2-8-6-4-3-5-7-8;1-4-5-9-7(8)6(2)3;1-3-5-6-9-7(8)4-2;1-4(2)5(6)7-3/h2-7H,1H2;4H,1-2,5H2,3H3;4H,2-3,5-6H2,1H3;1H2,2-3H3