methyl 2-[2-azanyl-4,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]sulfonylethanoate

Systemtic Name: methyl 2-[2-azanyl-4,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]sulfonylethanoate Openeye Name: methyl 2-(2-amino-1-benzyl-4,5-dimethyl-pyrrol-3-yl)sulfonylacetate CAS Name: 2-[[2-amino-4,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]sulfonyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-amino-1-benzyl-4,5-dimethylpyrrol-3-yl)sulfonylacetate Traditional Name: 2-(2-amino-1-benzyl-4,5-dimethyl-pyrrol-3-yl)sulfonylacetic acid methyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)CC(=O)OC)N)CC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)CC(=O)OC)N)CC2=CC=CC=C2)C

InChI

InChI=1S/C16H20N2O4S/c1-11-12(2)18(9-13-7-5-4-6-8-13)16(17)15(11)23(20,21)10-14(19)22-3/h4-8H,9-10,17H2,1-3H3