8-[(3-phenylpyrrolidin-1-yl)methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide

Systemtic Name: 8-[(3-phenylpyrrolidin-1-yl)methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide Openeye Name: 8-[(3-phenylpyrrolidin-1-yl)methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide CAS Name: 8-[(3-phenyl-1-pyrrolidinyl)methyl]-5,6-dihydrobenzo[b][1]benzoxepin-3-carboxamide IUPAC Name: 8-[(3-phenylpyrrolidin-1-yl)methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide Traditional Name: 8-[(3-phenylpyrrolidino)methyl]-5,6-dihydrobenzo[b][1]benzoxepin-3-carboxamide Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C2=CC=CC=C2)CC3=CC4=C(C=C3)OC5=C(CC4)C=C(C=C5)C(=O)N

Isomeric SMILES

C1CN(CC1C2=CC=CC=C2)CC3=CC4=C(C=C3)OC5=C(CC4)C=C(C=C5)C(=O)N

InChI

InChI=1S/C26H26N2O2/c27-26(29)22-9-11-25-21(15-22)8-7-20-14-18(6-10-24(20)30-25)16-28-13-12-23(17-28)19-4-2-1-3-5-19/h1-6,9-11,14-15,23H,7-8,12-13,16-17H2,(H2,27,29)