butyl prop-2-enoate; 1-ethenyl-2-methyl-benzene; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid

Systemtic Name: butyl prop-2-enoate; 1-ethenyl-2-methyl-benzene; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid Openeye Name: butyl prop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; 1-methyl-2-vinyl-benzene CAS Name: 1-ethenyl-2-methylbenzene; 2-methyl-2-propenoic acid; 2-methyl-2-propenoic acid methyl ester; 2-propenoic acid butyl ester IUPAC Name: butyl prop-2-enoate; 1-ethenyl-2-methylbenzene; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid Traditional Name: acrylic acid butyl ester; methacrylic acid; 2-methylacrylic acid methyl ester; 1-methyl-2-vinyl-benzene Formula: C25H36O6 MolecularWeight: 432.54974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=C.CC1=CC=CC=C1C=C.CC(=C)C(=O)O.CC(=C)C(=O)OC

Isomeric SMILES

CCCCOC(=O)C=C.CC1=CC=CC=C1C=C.CC(=C)C(=O)O.CC(=C)C(=O)OC

InChI

InChI=1S/C9H10.C7H12O2.C5H8O2.C4H6O2/c1-3-9-7-5-4-6-8(9)2;1-3-5-6-9-7(8)4-2;1-4(2)5(6)7-3;1-3(2)4(5)6/h3-7H,1H2,2H3;4H,2-3,5-6H2,1H3;1H2,2-3H3;1H2,2H3,(H,5,6)