(phenylmethyl) 9-(4-chloranylnaphthalen-1-yl)carbonyl-1,2,3,4-tetrahydrocarbazole-4-carboxylate

Systemtic Name: (phenylmethyl) 9-(4-chloranylnaphthalen-1-yl)carbonyl-1,2,3,4-tetrahydrocarbazole-4-carboxylate Openeye Name: benzyl 9-(4-chloronaphthalene-1-carbonyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylate CAS Name: 9-[(4-chloro-1-naphthalenyl)-oxomethyl]-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-(4-chloronaphthalene-1-carbonyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylate Traditional Name: 9-(4-chloro-1-naphthoyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid benzyl ester Formula: C31H24ClNO3 MolecularWeight: 493.98016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(C3=CC=CC=C32)C(=O)C4=CC=C(C5=CC=CC=C54)Cl)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1CC(C2=C(C1)N(C3=CC=CC=C32)C(=O)C4=CC=C(C5=CC=CC=C54)Cl)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C31H24ClNO3/c32-26-18-17-23(21-11-4-5-12-22(21)26)30(34)33-27-15-7-6-13-24(27)29-25(14-8-16-28(29)33)31(35)36-19-20-9-2-1-3-10-20/h1-7,9-13,15,17-18,25H,8,14,16,19H2