buta-1,3-diene; ethenylbenzene; 2-ethylhexyl prop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enenitrile

Systemtic Name: buta-1,3-diene; ethenylbenzene; 2-ethylhexyl prop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enenitrile Openeye Name: buta-1,3-diene; 2-ethylhexyl prop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene CAS Name: buta-1,3-diene; 2-methyl-2-propenoic acid methyl ester; 2-propenenitrile; 2-propenoic acid 2-ethylhexyl ester; styrene IUPAC Name: buta-1,3-diene; 2-ethylhexyl prop-2-enoate; methyl 2-methylprop-2-enoate; prop-2-enenitrile; styrene Traditional Name: acrylic acid 2-ethylhexyl ester; acrylonitrile; buta-1,3-diene; 2-methylacrylic acid methyl ester; styrene Formula: C31H45NO4 MolecularWeight: 495.6933

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C=C.CC(=C)C(=O)OC.C=CC=C.C=CC#N.C=CC1=CC=CC=C1

Isomeric SMILES

CCCCC(CC)COC(=O)C=C.CC(=C)C(=O)OC.C=CC=C.C=CC#N.C=CC1=CC=CC=C1

InChI

InChI=1S/C11H20O2.C8H8.C5H8O2.C4H6.C3H3N/c1-4-7-8-10(5-2)9-13-11(12)6-3;1-2-8-6-4-3-5-7-8;1-4(2)5(6)7-3;1-3-4-2;1-2-3-4/h6,10H,3-5,7-9H2,1-2H3;2-7H,1H2;1H2,2-3H3;3-4H,1-2H2;2H,1H2