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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCOC1=CC=C(C=C1)C2CC(=CC3=CC=CC=C3N2C=O)C(=O)O

Isomeric SMILES

CCOCCCOC1=CC=C(C=C1)C2CC(=CC3=CC=CC=C3N2C=O)C(=O)O

InChI

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