1-(3-methyl-1-phenyl-butan-2-yl)pyrrolidine; 2,4,6-trinitrophenol

Systemtic Name: 1-(3-methyl-1-phenyl-butan-2-yl)pyrrolidine; 2,4,6-trinitrophenol Openeye Name: 1-(1-benzyl-2-methyl-propyl)pyrrolidine; picric acid CAS Name: 1-(3-methyl-1-phenylbutan-2-yl)pyrrolidine; 2,4,6-trinitrophenol IUPAC Name: 1-(3-methyl-1-phenylbutan-2-yl)pyrrolidine; 2,4,6-trinitrophenol Traditional Name: 1-(1-benzyl-2-methyl-propyl)pyrrolidine; picric acid Formula: C21H26N4O7 MolecularWeight: 446.45374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC=CC=C1)N2CCCC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)C(CC1=CC=CC=C1)N2CCCC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H23N.C6H3N3O7/c1-13(2)15(16-10-6-7-11-16)12-14-8-4-3-5-9-14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-5,8-9,13,15H,6-7,10-12H2,1-2H3;1-2,10H