3,3a,6a-triethyl-6-ethylidene-1,2,4,5-tetraphenyl-1H-pentalene

Systemtic Name: 3,3a,6a-triethyl-6-ethylidene-1,2,4,5-tetraphenyl-1H-pentalene Openeye Name: 3,3a,6a-triethyl-6-ethylidene-1,2,4,5-tetraphenyl-1H-pentalene CAS Name: 3,3a,6a-triethyl-6-ethylidene-1,2,4,5-tetraphenyl-1H-pentalene IUPAC Name: 3,3a,6a-triethyl-6-ethylidene-1,2,4,5-tetraphenyl-1H-pentalene Traditional Name: 3,3a,6a-triethyl-6-ethylidene-1,2,4,5-tetraphenyl-1H-pentalene Formula: C40H40 MolecularWeight: 520.7456

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C2(C1(C(=C(C2=CC)C3=CC=CC=C3)C4=CC=CC=C4)CC)CC)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCC1=C(C(C2(C1(C(=C(C2=CC)C3=CC=CC=C3)C4=CC=CC=C4)CC)CC)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C40H40/c1-5-33-35(29-21-13-9-14-22-29)37(31-25-17-11-18-26-31)40(8-4)34(6-2)36(30-23-15-10-16-24-30)38(39(33,40)7-3)32-27-19-12-20-28-32/h5,9-28,38H,6-8H2,1-4H3