N-[3-[3-(3,4-dimethoxyphenyl)propylamino]propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[3-(3,4-dimethoxyphenyl)propylamino]propyl]-4-nitro-benzamide Openeye Name: N-[3-[3-(3,4-dimethoxyphenyl)propylamino]propyl]-4-nitro-benzamide CAS Name: N-[3-[3-(3,4-dimethoxyphenyl)propylamino]propyl]-4-nitrobenzamide IUPAC Name: N-[3-[3-(3,4-dimethoxyphenyl)propylamino]propyl]-4-nitrobenzamide Traditional Name: N-[3-[3-(3,4-dimethoxyphenyl)propylamino]propyl]-4-nitro-benzamide Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCCNCCCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCCNCCCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C21H27N3O5/c1-28-19-11-6-16(15-20(19)29-2)5-3-12-22-13-4-14-23-21(25)17-7-9-18(10-8-17)24(26)27/h6-11,15,22H,3-5,12-14H2,1-2H3,(H,23,25)