4-(2-methyl-3-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoate

Systemtic Name: 4-(2-methyl-3-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoate Openeye Name: 4-(2-methyl-3-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoate CAS Name: 4-(2-methyl-3-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoate IUPAC Name: 4-(2-methyl-3-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoate Traditional Name: 4-(2-methyl-3-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoate Formula: C22H20NO2- MolecularWeight: 330.3997

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=C(C=C3)C(=O)[O-])CCCC2)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)C(=O)[O-])CCCC2)C4=CC=CC=C4

InChI

InChI=1S/C22H21NO2/c1-15-21(16-7-3-2-4-8-16)19-9-5-6-10-20(19)23(15)18-13-11-17(12-14-18)22(24)25/h2-4,7-8,11-14H,5-6,9-10H2,1H3,(H,24,25)/p-1