[2-methyl-3,5-dinitro-4-(pentan-3-ylamino)phenyl]methanol

Systemtic Name: [2-methyl-3,5-dinitro-4-(pentan-3-ylamino)phenyl]methanol Openeye Name: [4-(1-ethylpropylamino)-2-methyl-3,5-dinitro-phenyl]methanol CAS Name: [2-methyl-3,5-dinitro-4-(pentan-3-ylamino)phenyl]methanol IUPAC Name: [2-methyl-3,5-dinitro-4-(pentan-3-ylamino)phenyl]methanol Traditional Name: [4-(1-ethylpropylamino)-2-methyl-3,5-dinitro-phenyl]methanol Formula: C13H19N3O5 MolecularWeight: 297.30706

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)CO)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)CO)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O5/c1-4-10(5-2)14-12-11(15(18)19)6-9(7-17)8(3)13(12)16(20)21/h6,10,14,17H,4-5,7H2,1-3H3