2-(4-butoxyphenoxy)-N-(2-dimethylaminoethyl)-N-(4-methoxyphenyl)ethanamide; 2,4,6-trinitrophenol

Systemtic Name: 2-(4-butoxyphenoxy)-N-(2-dimethylaminoethyl)-N-(4-methoxyphenyl)ethanamide; 2,4,6-trinitrophenol Openeye Name: 2-(4-butoxyphenoxy)-N-(2-dimethylaminoethyl)-N-(4-methoxyphenyl)acetamide; picric acid CAS Name: 2-(4-butoxyphenoxy)-N-(2-dimethylaminoethyl)-N-(4-methoxyphenyl)acetamide; 2,4,6-trinitrophenol IUPAC Name: 2-(4-butoxyphenoxy)-N-(2-dimethylaminoethyl)-N-(4-methoxyphenyl)acetamide; 2,4,6-trinitrophenol Traditional Name: 2-(4-butoxyphenoxy)-N-(2-dimethylaminoethyl)-N-(4-methoxyphenyl)acetamide; picric acid Formula: C29H35N5O11 MolecularWeight: 629.6151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OCC(=O)N(CCN(C)C)C2=CC=C(C=C2)OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OCC(=O)N(CCN(C)C)C2=CC=C(C=C2)OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H32N2O4.C6H3N3O7/c1-5-6-17-28-21-11-13-22(14-12-21)29-18-23(26)25(16-15-24(2)3)19-7-9-20(27-4)10-8-19;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h7-14H,5-6,15-18H2,1-4H3;1-2,10H