1-[1-adamantylmethyl(methyl)amino]-3-(3-nitrophenoxy)propan-2-ol

Systemtic Name: 1-[1-adamantylmethyl(methyl)amino]-3-(3-nitrophenoxy)propan-2-ol Openeye Name: 1-[1-adamantylmethyl(methyl)amino]-3-(3-nitrophenoxy)propan-2-ol CAS Name: 1-[1-adamantylmethyl(methyl)amino]-3-(3-nitrophenoxy)-2-propanol IUPAC Name: 1-[1-adamantylmethyl(methyl)amino]-3-(3-nitrophenoxy)propan-2-ol Traditional Name: 1-[1-adamantylmethyl(methyl)amino]-3-(3-nitrophenoxy)propan-2-ol Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(COC1=CC=CC(=C1)[N+](=O)[O-])O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(CC(COC1=CC=CC(=C1)[N+](=O)[O-])O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H30N2O4/c1-22(14-21-9-15-5-16(10-21)7-17(6-15)11-21)12-19(24)13-27-20-4-2-3-18(8-20)23(25)26/h2-4,8,15-17,19,24H,5-7,9-14H2,1H3