ethyl 4-(2-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoate

Systemtic Name: ethyl 4-(2-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoate Openeye Name: ethyl 4-(2-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoate CAS Name: 4-(2-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoate Traditional Name: 4-(2-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid ethyl ester Formula: C24H25NO2 MolecularWeight: 359.4608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C3=C(CCCCC3)C=C2C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C3=C(CCCCC3)C=C2C4=CC=CC=C4

InChI

InChI=1S/C24H25NO2/c1-2-27-24(26)19-13-15-21(16-14-19)25-22-12-8-4-7-11-20(22)17-23(25)18-9-5-3-6-10-18/h3,5-6,9-10,13-17H,2,4,7-8,11-12H2,1H3