(Z)-2-butylbut-2-enedioic acid; butyl prop-2-enoate; ethenylbenzene

Systemtic Name: (Z)-2-butylbut-2-enedioic acid; butyl prop-2-enoate; ethenylbenzene Openeye Name: (Z)-2-butylbut-2-enedioic acid; butyl prop-2-enoate; styrene CAS Name: (Z)-2-butyl-2-butenedioic acid; 2-propenoic acid butyl ester; styrene IUPAC Name: (Z)-2-butylbut-2-enedioic acid; butyl prop-2-enoate; styrene Traditional Name: acrylic acid butyl ester; (Z)-2-butylbut-2-enedioic acid; styrene Formula: C23H32O6 MolecularWeight: 404.49658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC(=O)O)C(=O)O.CCCCOC(=O)C=C.C=CC1=CC=CC=C1

Isomeric SMILES

CCCC/C(=C/C(=O)O)/C(=O)O.CCCCOC(=O)C=C.C=CC1=CC=CC=C1

InChI

InChI=1S/C8H12O4.C8H8.C7H12O2/c1-2-3-4-6(8(11)12)5-7(9)10;1-2-8-6-4-3-5-7-8;1-3-5-6-9-7(8)4-2/h5H,2-4H2,1H3,(H,9,10)(H,11,12);2-7H,1H2;4H,2-3,5-6H2,1H3/b6-5-;;