methyl (2S)-2-[[2-methyl-1-(2-morpholin-4-ylethyl)pyrrol-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[2-methyl-1-(2-morpholin-4-ylethyl)pyrrol-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-methyl-1-(2-morpholinoethyl)pyrrole-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[2-methyl-1-[2-(4-morpholinyl)ethyl]-3-pyrrolyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-methyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-methyl-1-(2-morpholinoethyl)pyrrole-3-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN1CCN2CCOCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CN1CCN2CCOCC2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H29N3O4/c1-17-19(8-9-25(17)11-10-24-12-14-29-15-13-24)21(26)23-20(22(27)28-2)16-18-6-4-3-5-7-18/h3-9,20H,10-16H2,1-2H3,(H,23,26)/t20-/m0/s1