(3-nitrophenyl) N-[3-[3-(dimethylamino)propylamino]-3-oxidanylidene-propyl]-N-octadecyl-carbamate

Systemtic Name: (3-nitrophenyl) N-[3-[3-(dimethylamino)propylamino]-3-oxidanylidene-propyl]-N-octadecyl-carbamate Openeye Name: (3-nitrophenyl) N-[3-[3-(dimethylamino)propylamino]-3-oxo-propyl]-N-octadecyl-carbamate CAS Name: N-[3-[3-(dimethylamino)propylamino]-3-oxopropyl]-N-octadecylcarbamic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) N-[3-[3-(dimethylamino)propylamino]-3-oxopropyl]-N-octadecylcarbamate Traditional Name: N-[3-[3-(dimethylamino)propylamino]-3-keto-propyl]-N-stearyl-carbamic acid (3-nitrophenyl) ester Formula: C33H58N4O5 MolecularWeight: 590.83742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCC(=O)NCCCN(C)C)C(=O)OC1=CC=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCC(=O)NCCCN(C)C)C(=O)OC1=CC=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C33H58N4O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27-36(28-24-32(38)34-25-21-26-35(2)3)33(39)42-31-23-20-22-30(29-31)37(40)41/h20,22-23,29H,4-19,21,24-28H2,1-3H3,(H,34,38)