1,2,3,4-tetrakis[4-(propylamino)phenyl]anthracene-9,10-diamine

Systemtic Name: 1,2,3,4-tetrakis[4-(propylamino)phenyl]anthracene-9,10-diamine Openeye Name: 1,2,3,4-tetrakis[4-(propylamino)phenyl]anthracene-9,10-diamine CAS Name: 1,2,3,4-tetrakis[4-(propylamino)phenyl]anthracene-9,10-diamine IUPAC Name: 1,2,3,4-tetrakis[4-(propylamino)phenyl]anthracene-9,10-diamine Traditional Name: [4-[9,10-diamino-1,3,4-tris[4-(propylamino)phenyl]-2-anthryl]phenyl]-propyl-amine Formula: C50H56N6 MolecularWeight: 741.01984

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=CC=C(C=C1)C2=C(C3=C(C4=CC=CC=C4C(=C3C(=C2C5=CC=C(C=C5)NCCC)C6=CC=C(C=C6)NCCC)N)N)C7=CC=C(C=C7)NCCC

Isomeric SMILES

CCCNC1=CC=C(C=C1)C2=C(C3=C(C4=CC=CC=C4C(=C3C(=C2C5=CC=C(C=C5)NCCC)C6=CC=C(C=C6)NCCC)N)N)C7=CC=C(C=C7)NCCC

InChI

InChI=1S/C50H56N6/c1-5-29-53-37-21-13-33(14-22-37)43-44(34-15-23-38(24-16-34)54-30-6-2)46(36-19-27-40(28-20-36)56-32-8-4)48-47(49(51)41-11-9-10-12-42(41)50(48)52)45(43)35-17-25-39(26-18-35)55-31-7-3/h9-28,53-56H,5-8,29-32,51-52H2,1-4H3