1-[1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)butan-2-ylamino]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)butan-2-ylamino]-3-phenoxy-propan-2-ol Openeye Name: 1-[1-(6,11-dihydrobenzo[c][1]benzoxepin-11-ylmethyl)propylamino]-3-phenoxy-propan-2-ol CAS Name: 1-[1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)butan-2-ylamino]-3-phenoxy-2-propanol IUPAC Name: 1-[1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)butan-2-ylamino]-3-phenoxypropan-2-ol Traditional Name: 1-[1-(6,11-dihydrobenzo[c][1]benzoxepin-11-ylmethyl)propylamino]-3-phenoxy-propan-2-ol Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1C2=CC=CC=C2COC3=CC=CC=C13)NCC(COC4=CC=CC=C4)O

Isomeric SMILES

CCC(CC1C2=CC=CC=C2COC3=CC=CC=C13)NCC(COC4=CC=CC=C4)O

InChI

InChI=1S/C27H31NO3/c1-2-21(28-17-22(29)19-30-23-11-4-3-5-12-23)16-26-24-13-7-6-10-20(24)18-31-27-15-9-8-14-25(26)27/h3-15,21-22,26,28-29H,2,16-19H2,1H3