4-butylaniline; 4-methylaniline; phenanthrene

Systemtic Name: 4-butylaniline; 4-methylaniline; phenanthrene Openeye Name: 4-butylaniline; 4-methylaniline; phenanthrene CAS Name: 4-butylaniline; 4-methylaniline; phenanthrene IUPAC Name: 4-butylaniline; 4-methylaniline; phenanthrene Traditional Name: (4-butylphenyl)amine; phenanthrene; p-toluidine Formula: C31H34N2 MolecularWeight: 434.61506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N.CC1=CC=C(C=C1)N.C1=CC=C2C(=C1)C=CC3=CC=CC=C32

Isomeric SMILES

CCCCC1=CC=C(C=C1)N.CC1=CC=C(C=C1)N.C1=CC=C2C(=C1)C=CC3=CC=CC=C32

InChI

InChI=1S/C14H10.C10H15N.C7H9N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;1-2-3-4-9-5-7-10(11)8-6-9;1-6-2-4-7(8)5-3-6/h1-10H;5-8H,2-4,11H2,1H3;2-5H,8H2,1H3