methyl 7-[[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylamino]heptanoate Openeye Name: methyl 7-[(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)amino]heptanoate CAS Name: 7-[[[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[(1-benzyl-2,5-dimethylpyrrole-3-carbonyl)amino]heptanoate Traditional Name: 7-[(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)amino]enanthic acid methyl ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C22H30N2O3/c1-17-15-20(18(2)24(17)16-19-11-7-6-8-12-19)22(26)23-14-10-5-4-9-13-21(25)27-3/h6-8,11-12,15H,4-5,9-10,13-14,16H2,1-3H3,(H,23,26)