methyl 2-[7-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propanoate

Systemtic Name: methyl 2-[7-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propanoate Openeye Name: methyl 2-[7-[(4-benzyloxy-1-piperidyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propanoate CAS Name: 2-[7-[(4-phenylmethoxy-1-piperidinyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propanoic acid methyl ester IUPAC Name: methyl 2-[7-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propanoate Traditional Name: 2-[7-[(4-benzoxypiperidino)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propionic acid methyl ester Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1CCOC2=C(C1)C=C(C=C2)CN3CCC(CC3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OC)N1CCOC2=C(C1)C=C(C=C2)CN3CCC(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H34N2O4/c1-20(26(29)30-2)28-14-15-31-25-9-8-22(16-23(25)18-28)17-27-12-10-24(11-13-27)32-19-21-6-4-3-5-7-21/h3-9,16,20,24H,10-15,17-19H2,1-2H3