(2S)-2-[[2-(2-azanylethyl)pyrrol-1-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[2-(2-azanylethyl)pyrrol-1-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-(2-aminoethyl)pyrrole-1-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[[2-(2-aminoethyl)-1-pyrrolyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[2-(2-aminoethyl)pyrrole-1-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-(2-aminoethyl)pyrrole-1-carbonyl]amino]-3-phenyl-propionic acid Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)N2C=CC=C2CCN

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)N2C=CC=C2CCN

InChI

InChI=1S/C16H19N3O3/c17-9-8-13-7-4-10-19(13)16(22)18-14(15(20)21)11-12-5-2-1-3-6-12/h1-7,10,14H,8-9,11,17H2,(H,18,22)(H,20,21)/t14-/m0/s1