2-[1-(4-hydroxyphenyl)propan-2-ylamino]-5-nitro-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride

Systemtic Name: 2-[1-(4-hydroxyphenyl)propan-2-ylamino]-5-nitro-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride Openeye Name: 6-benzyloxy-2-[[2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]-5-nitro-tetralin-1-ol hydrochloride CAS Name: 2-[1-(4-hydroxyphenyl)propan-2-ylamino]-5-nitro-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride IUPAC Name: 2-[1-(4-hydroxyphenyl)propan-2-ylamino]-5-nitro-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride Traditional Name: 6-benzoxy-2-[[2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]-5-nitro-tetralin-1-ol hydrochloride Formula: C26H29ClN2O5 MolecularWeight: 484.97186

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)O)NC2CCC3=C(C2O)C=CC(=C3[N+](=O)[O-])OCC4=CC=CC=C4.Cl

Isomeric SMILES

CC(CC1=CC=C(C=C1)O)NC2CCC3=C(C2O)C=CC(=C3[N+](=O)[O-])OCC4=CC=CC=C4.Cl

InChI

InChI=1S/C26H28N2O5.ClH/c1-17(15-18-7-9-20(29)10-8-18)27-23-13-11-21-22(26(23)30)12-14-24(25(21)28(31)32)33-16-19-5-3-2-4-6-19;/h2-10,12,14,17,23,26-27,29-30H,11,13,15-16H2,1H3;1H