buta-1,3-diene; ethenylbenzene; methanal; phenol; prop-2-enenitrile

Systemtic Name: buta-1,3-diene; ethenylbenzene; methanal; phenol; prop-2-enenitrile Openeye Name: buta-1,3-diene; formaldehyde; phenol; prop-2-enenitrile; styrene CAS Name: buta-1,3-diene; formaldehyde; phenol; 2-propenenitrile; styrene IUPAC Name: buta-1,3-diene; formaldehyde; phenol; prop-2-enenitrile; styrene Traditional Name: acrylonitrile; buta-1,3-diene; formaldehyde; phenol; styrene Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=C.C=CC#N.C=CC1=CC=CC=C1.C=O.C1=CC=C(C=C1)O

Isomeric SMILES

C=CC=C.C=CC#N.C=CC1=CC=CC=C1.C=O.C1=CC=C(C=C1)O

InChI

InChI=1S/C8H8.C6H6O.C4H6.C3H3N.CH2O/c1-2-8-6-4-3-5-7-8;7-6-4-2-1-3-5-6;1-3-4-2;1-2-3-4;1-2/h2-7H,1H2;1-5,7H;3-4H,1-2H2;2H,1H2;1H2