2-[11-(2-dimethylaminoethylimino)-6H-benzo[c][1]benzoxepin-2-yl]propanoic acid

Systemtic Name: 2-[11-(2-dimethylaminoethylimino)-6H-benzo[c][1]benzoxepin-2-yl]propanoic acid Openeye Name: 2-[11-(2-dimethylaminoethylimino)-6H-benzo[c][1]benzoxepin-2-yl]propanoic acid CAS Name: 2-[11-(2-dimethylaminoethylimino)-6H-benzo[c][1]benzoxepin-2-yl]propanoic acid IUPAC Name: 2-[11-(2-dimethylaminoethylimino)-6H-benzo[c][1]benzoxepin-2-yl]propanoic acid Traditional Name: 2-[11-(2-dimethylaminoethylimino)-6H-benzo[c][1]benzoxepin-2-yl]propionic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC3=CC=CC=C3C2=NCCN(C)C)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCC3=CC=CC=C3C2=NCCN(C)C)C(=O)O

InChI

InChI=1S/C21H24N2O3/c1-14(21(24)25)15-8-9-19-18(12-15)20(22-10-11-23(2)3)17-7-5-4-6-16(17)13-26-19/h4-9,12,14H,10-11,13H2,1-3H3,(H,24,25)