4-methanoyl-1-[4-(2-propan-2-yloxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-2-carboxylic acid

Systemtic Name: 4-methanoyl-1-[4-(2-propan-2-yloxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-2-carboxylic acid Openeye Name: 4-formyl-1-[4-(2-isopropoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-2-carboxylic acid CAS Name: 4-formyl-1-[4-(2-propan-2-yloxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-2-carboxylic acid IUPAC Name: 4-formyl-1-[4-(2-propan-2-yloxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-2-carboxylic acid Traditional Name: 4-formyl-1-[4-(2-isopropoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-2-carboxylic acid Formula: C23H25NO5 MolecularWeight: 395.4483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCOC1=CC=C(C=C1)N2C(CC(=CC3=CC=CC=C32)C=O)C(=O)O

Isomeric SMILES

CC(C)OCCOC1=CC=C(C=C1)N2C(CC(=CC3=CC=CC=C32)C=O)C(=O)O

InChI

InChI=1S/C23H25NO5/c1-16(2)28-11-12-29-20-9-7-19(8-10-20)24-21-6-4-3-5-18(21)13-17(15-25)14-22(24)23(26)27/h3-10,13,15-16,22H,11-12,14H2,1-2H3,(H,26,27)