1-[(2-methyl-4-phenyl-butan-2-yl)amino]-3-(3-nitro-2-prop-2-enoxy-phenoxy)propan-2-ol

Systemtic Name: 1-[(2-methyl-4-phenyl-butan-2-yl)amino]-3-(3-nitro-2-prop-2-enoxy-phenoxy)propan-2-ol Openeye Name: 1-(2-allyloxy-3-nitro-phenoxy)-3-[(1,1-dimethyl-3-phenyl-propyl)amino]propan-2-ol CAS Name: 1-[(2-methyl-4-phenylbutan-2-yl)amino]-3-(3-nitro-2-prop-2-enoxyphenoxy)-2-propanol IUPAC Name: 1-[(2-methyl-4-phenylbutan-2-yl)amino]-3-(3-nitro-2-prop-2-enoxyphenoxy)propan-2-ol Traditional Name: 1-(2-allyloxy-3-nitro-phenoxy)-3-[(1,1-dimethyl-3-phenyl-propyl)amino]propan-2-ol Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC=CC=C1)NCC(COC2=CC=CC(=C2OCC=C)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(CCC1=CC=CC=C1)NCC(COC2=CC=CC(=C2OCC=C)[N+](=O)[O-])O

InChI

InChI=1S/C23H30N2O5/c1-4-15-29-22-20(25(27)28)11-8-12-21(22)30-17-19(26)16-24-23(2,3)14-13-18-9-6-5-7-10-18/h4-12,19,24,26H,1,13-17H2,2-3H3