5-nitro-6-phenylmethoxy-2-(1-phenylpropan-2-ylamino)-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride

Systemtic Name: 5-nitro-6-phenylmethoxy-2-(1-phenylpropan-2-ylamino)-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride Openeye Name: 6-benzyloxy-2-[(1-methyl-2-phenyl-ethyl)amino]-5-nitro-tetralin-1-ol hydrochloride CAS Name: 5-nitro-6-phenylmethoxy-2-(1-phenylpropan-2-ylamino)-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride IUPAC Name: 5-nitro-6-phenylmethoxy-2-(1-phenylpropan-2-ylamino)-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride Traditional Name: 6-benzoxy-2-[(1-methyl-2-phenyl-ethyl)amino]-5-nitro-tetralin-1-ol hydrochloride Formula: C26H29ClN2O4 MolecularWeight: 468.97246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O4.ClH/c1-18(16-19-8-4-2-5-9-19)27-23-14-12-21-22(26(23)29)13-15-24(25(21)28(30)31)32-17-20-10-6-3-7-11-20;/h2-11,13,15,18,23,26-27,29H,12,14,16-17H2,1H3;1H