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methyl 3-[3-(diethylamino)propylcarbamoyl]-5-nitro-benzoate

methyl 3-[3-(diethylamino)propylcarbamoyl]-5-nitro-benzoate

Systemtic Name:methyl 3-[3-(diethylamino)propylcarbamoyl]-5-nitro-benzoate
Openeye Name:methyl 3-[3-(diethylamino)propylcarbamoyl]-5-nitro-benzoate
CAS Name:3-[[3-(diethylamino)propylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester
IUPAC Name:methyl 3-[3-(diethylamino)propylcarbamoyl]-5-nitrobenzoate
Traditional Name:3-[3-(diethylamino)propylcarbamoyl]-5-nitro-benzoic acid methyl ester
Formula: C16H23N3O5
MolecularWeight: 337.37092
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H23N3O5/c1-4-18(5-2)8-6-7-17-15(20)12-9-13(16(21)24-3)11-14(10-12)19(22)23/h9-11H,4-8H2,1-3H3,(H,17,20)


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