methyl 3-(4-aminocarbonyl-5-methyl-1-phenethyl-3-pyridin-3-yl-pyrrol-2-yl)propanoate

Systemtic Name: methyl 3-(4-aminocarbonyl-5-methyl-1-phenethyl-3-pyridin-3-yl-pyrrol-2-yl)propanoate Openeye Name: methyl 3-[4-carbamoyl-5-methyl-1-phenethyl-3-(3-pyridyl)pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-5-methyl-1-phenethyl-3-(3-pyridinyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(4-carbamoyl-5-methyl-1-phenethyl-3-pyridin-3-ylpyrrol-2-yl)propanoate Traditional Name: 3-[4-carbamoyl-5-methyl-1-phenethyl-3-(3-pyridyl)pyrrol-2-yl]propionic acid methyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCC2=CC=CC=C2)CCC(=O)OC)C3=CN=CC=C3)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCC2=CC=CC=C2)CCC(=O)OC)C3=CN=CC=C3)C(=O)N

InChI

InChI=1S/C23H25N3O3/c1-16-21(23(24)28)22(18-9-6-13-25-15-18)19(10-11-20(27)29-2)26(16)14-12-17-7-4-3-5-8-17/h3-9,13,15H,10-12,14H2,1-2H3,(H2,24,28)