N2,4-bis(2-diethylaminoethyl)-3-nitro-benzene-1,2-diamine

Systemtic Name: N2,4-bis(2-diethylaminoethyl)-3-nitro-benzene-1,2-diamine Openeye Name: N2,4-bis(2-diethylaminoethyl)-3-nitro-benzene-1,2-diamine CAS Name: N2,4-bis(2-diethylaminoethyl)-3-nitrobenzene-1,2-diamine IUPAC Name: 2-N,4-bis(2-diethylaminoethyl)-3-nitrobenzene-1,2-diamine Traditional Name: 2-[4-amino-3-(2-diethylaminoethylamino)-2-nitro-phenyl]ethyl-diethyl-amine Formula: C18H33N5O2 MolecularWeight: 351.48692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=C(C(=C(C=C1)N)NCCN(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCC1=C(C(=C(C=C1)N)NCCN(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C18H33N5O2/c1-5-21(6-2)13-11-15-9-10-16(19)17(18(15)23(24)25)20-12-14-22(7-3)8-4/h9-10,20H,5-8,11-14,19H2,1-4H3