4-ethoxy-5-methoxy-N-[3-[methyl-(phenylmethyl)amino]propyl]-2-nitro-benzamide

Systemtic Name: 4-ethoxy-5-methoxy-N-[3-[methyl-(phenylmethyl)amino]propyl]-2-nitro-benzamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-4-ethoxy-5-methoxy-2-nitro-benzamide CAS Name: 4-ethoxy-5-methoxy-N-[3-[methyl-(phenylmethyl)amino]propyl]-2-nitrobenzamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-4-ethoxy-5-methoxy-2-nitrobenzamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-4-ethoxy-5-methoxy-2-nitro-benzamide Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NCCCN(C)CC2=CC=CC=C2)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NCCCN(C)CC2=CC=CC=C2)OC

InChI

InChI=1S/C21H27N3O5/c1-4-29-20-14-18(24(26)27)17(13-19(20)28-3)21(25)22-11-8-12-23(2)15-16-9-6-5-7-10-16/h5-7,9-10,13-14H,4,8,11-12,15H2,1-3H3,(H,22,25)