5-bromanyl-4,8b-dimethyl-3-phenethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol; 2-oxidanylbenzoic acid

Systemtic Name: 5-bromanyl-4,8b-dimethyl-3-phenethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol; 2-oxidanylbenzoic acid Openeye Name: 5-bromo-4,8b-dimethyl-3-phenethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol; 2-hydroxybenzoic acid CAS Name: 5-bromo-4,8b-dimethyl-3-phenethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol; 2-hydroxybenzoic acid IUPAC Name: 5-bromo-4,8b-dimethyl-3-phenethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol; 2-hydroxybenzoic acid Traditional Name: 5-bromo-4,8b-dimethyl-3-phenethyl-2,3a-dihydro-1H-pyrrol[2,3-b]indol-7-ol; salicylic acid Formula: C27H29BrN2O4 MolecularWeight: 525.43416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCN(C1N(C3=C(C=C(C=C23)O)Br)C)CCC4=CC=CC=C4.C1=CC=C(C(=C1)C(=O)O)O

Isomeric SMILES

CC12CCN(C1N(C3=C(C=C(C=C23)O)Br)C)CCC4=CC=CC=C4.C1=CC=C(C(=C1)C(=O)O)O

InChI

InChI=1S/C20H23BrN2O.C7H6O3/c1-20-9-11-23(10-8-14-6-4-3-5-7-14)19(20)22(2)18-16(20)12-15(24)13-17(18)21;8-6-4-2-1-3-5(6)7(9)10/h3-7,12-13,19,24H,8-11H2,1-2H3;1-4,8H,(H,9,10)