N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitro-N-(phenylmethyl)aniline

Systemtic Name: N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitro-N-(phenylmethyl)aniline Openeye Name: N-benzyl-N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitro-aniline CAS Name: N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitro-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitroaniline Traditional Name: benzyl-[4-(2-diethylaminoethyloxy)phenyl]-(2,4-dinitrophenyl)amine Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)N(CC2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)N(CC2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C25H28N4O5/c1-3-26(4-2)16-17-34-23-13-10-21(11-14-23)27(19-20-8-6-5-7-9-20)24-15-12-22(28(30)31)18-25(24)29(32)33/h5-15,18H,3-4,16-17,19H2,1-2H3