3-[2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanoylamino]propyl nitrate

Systemtic Name: 3-[2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanoylamino]propyl nitrate Openeye Name: 3-[[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetyl]amino]propyl nitrate CAS Name: nitric acid 3-[[2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-1-oxoethyl]amino]propyl ester IUPAC Name: 3-[[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]amino]propyl nitrate Traditional Name: nitric acid 3-[[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetyl]amino]propyl ester Formula: C22H22ClN3O6 MolecularWeight: 459.87958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCCO[N+](=O)[O-]

InChI

InChI=1S/C22H22ClN3O6/c1-14-18(13-21(27)24-10-3-11-32-26(29)30)19-12-17(31-2)8-9-20(19)25(14)22(28)15-4-6-16(23)7-5-15/h4-9,12H,3,10-11,13H2,1-2H3,(H,24,27)