3-cyclohexyl-2-(2-phenyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1H-indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-2-(2-phenyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1H-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-2-(2-phenyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1H-indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-(2-phenyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1H-indole-6-carboxylic acid IUPAC Name: 3-cyclohexyl-2-(2-phenyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1H-indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-2-(2-phenyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1H-indole-6-carboxylic acid Formula: C29H28N2O3 MolecularWeight: 452.54422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(NC3=C2C=CC(=C3)C(=O)O)C4=CC5=C(C=C4)OC(CN5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C2=C(NC3=C2C=CC(=C3)C(=O)O)C4=CC5=C(C=C4)OC(CN5)C6=CC=CC=C6

InChI

InChI=1S/C29H28N2O3/c32-29(33)21-11-13-22-23(16-21)31-28(27(22)19-9-5-2-6-10-19)20-12-14-25-24(15-20)30-17-26(34-25)18-7-3-1-4-8-18/h1,3-4,7-8,11-16,19,26,30-31H,2,5-6,9-10,17H2,(H,32,33)