methyl 2-[2-[di(propan-2-yl)amino]ethylamino]-5-nitro-benzoate

Systemtic Name: methyl 2-[2-[di(propan-2-yl)amino]ethylamino]-5-nitro-benzoate Openeye Name: methyl 2-[2-(diisopropylamino)ethylamino]-5-nitro-benzoate CAS Name: 2-[2-[di(propan-2-yl)amino]ethylamino]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[2-[di(propan-2-yl)amino]ethylamino]-5-nitrobenzoate Traditional Name: 2-[2-(diisopropylamino)ethylamino]-5-nitro-benzoic acid methyl ester Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC)C(C)C

Isomeric SMILES

CC(C)N(CCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC)C(C)C

InChI

InChI=1S/C16H25N3O4/c1-11(2)18(12(3)4)9-8-17-15-7-6-13(19(21)22)10-14(15)16(20)23-5/h6-7,10-12,17H,8-9H2,1-5H3