3-[4-(3-benzo[b][1]benzazepin-11-ylpropoxy)phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-(3-benzo[b][1]benzazepin-11-ylpropoxy)phenyl]-2-ethoxy-propanoic acid Openeye Name: 3-[4-(3-benzo[b][1]benzazepin-11-ylpropoxy)phenyl]-2-ethoxy-propanoic acid CAS Name: 3-[4-[3-(11-benzo[b][1]benzazepinyl)propoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-(3-benzo[b][1]benzazepin-11-ylpropoxy)phenyl]-2-ethoxypropanoic acid Traditional Name: 3-[4-(3-benzo[b][1]benzazepin-11-ylpropoxy)phenyl]-2-ethoxy-propionic acid Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)C(=O)O

InChI

InChI=1S/C28H29NO4/c1-2-32-27(28(30)31)20-21-12-16-24(17-13-21)33-19-7-18-29-25-10-5-3-8-22(25)14-15-23-9-4-6-11-26(23)29/h3-6,8-17,27H,2,7,18-20H2,1H3,(H,30,31)