benzaldehyde; 1,2-dimethylbenzene; 1,3-dimethylbenzene; 1,4-dimethylbenzene

Systemtic Name: benzaldehyde; 1,2-dimethylbenzene; 1,3-dimethylbenzene; 1,4-dimethylbenzene Openeye Name: benzaldehyde; m-xylene; o-xylene; p-xylene CAS Name: benzaldehyde; 1,2-xylene; 1,3-xylene; 1,4-xylene IUPAC Name: benzaldehyde; 1,2-xylene; 1,3-xylene; 1,4-xylene Traditional Name: benzaldehyde; m-xylene; o-xylene; p-xylene Formula: C31H36O MolecularWeight: 424.61694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C.CC1=CC(=CC=C1)C.CC1=CC=CC=C1C.C1=CC=C(C=C1)C=O

Isomeric SMILES

CC1=CC=C(C=C1)C.CC1=CC(=CC=C1)C.CC1=CC=CC=C1C.C1=CC=C(C=C1)C=O

InChI

InChI=1S/3C8H10.C7H6O/c1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-7-5-3-4-6-8(7)2;8-6-7-4-2-1-3-5-7/h3*3-6H,1-2H3;1-6H