2-acetyloxy-5-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid

Systemtic Name: 2-acetyloxy-5-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Openeye Name: 2-acetoxy-5-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid CAS Name: 2-acetyloxy-5-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid IUPAC Name: 2-acetyloxy-5-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Traditional Name: 2-acetoxy-5-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Formula: C23H21NO4 MolecularWeight: 375.41714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)N2C3=C(CCCC3)C=C2C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)N2C3=C(CCCC3)C=C2C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H21NO4/c1-15(25)28-22-12-11-18(14-19(22)23(26)27)24-20-10-6-5-9-17(20)13-21(24)16-7-3-2-4-8-16/h2-4,7-8,11-14H,5-6,9-10H2,1H3,(H,26,27)