1-[(6-azanyl-7-nitro-2,3-dihydro-1H-inden-5-yl)oxy]-3-[2-phenoxypropyl-(phenylmethyl)amino]propan-2-ol

Systemtic Name: 1-[(6-azanyl-7-nitro-2,3-dihydro-1H-inden-5-yl)oxy]-3-[2-phenoxypropyl-(phenylmethyl)amino]propan-2-ol Openeye Name: 1-(6-amino-7-nitro-indan-5-yl)oxy-3-[benzyl(2-phenoxypropyl)amino]propan-2-ol CAS Name: 1-[(6-amino-7-nitro-2,3-dihydro-1H-inden-5-yl)oxy]-3-[2-phenoxypropyl-(phenylmethyl)amino]-2-propanol IUPAC Name: 1-[(6-amino-7-nitro-2,3-dihydro-1H-inden-5-yl)oxy]-3-[benzyl(2-phenoxypropyl)amino]propan-2-ol Traditional Name: 1-(6-amino-7-nitro-indan-5-yl)oxy-3-[benzyl(2-phenoxypropyl)amino]propan-2-ol Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC1=CC=CC=C1)CC(COC2=C(C(=C3CCCC3=C2)[N+](=O)[O-])N)O)OC4=CC=CC=C4

Isomeric SMILES

CC(CN(CC1=CC=CC=C1)CC(COC2=C(C(=C3CCCC3=C2)[N+](=O)[O-])N)O)OC4=CC=CC=C4

InChI

InChI=1S/C28H33N3O5/c1-20(36-24-12-6-3-7-13-24)16-30(17-21-9-4-2-5-10-21)18-23(32)19-35-26-15-22-11-8-14-25(22)28(27(26)29)31(33)34/h2-7,9-10,12-13,15,20,23,32H,8,11,14,16-19,29H2,1H3