1-[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(2-amino-4-methyl-pentanoyl)amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-amino-4-methyl-1-oxopentyl)amino]-3-(4-hydroxyphenyl)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(2-amino-4-methylpentanoyl)amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(2-amino-4-methyl-pentanoyl)amino]-3-(4-hydroxyphenyl)propanoyl]proline Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)N2CCCC2C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)N2CCCC2C(=O)O)N

InChI

InChI=1S/C20H29N3O5/c1-12(2)10-15(21)18(25)22-16(11-13-5-7-14(24)8-6-13)19(26)23-9-3-4-17(23)20(27)28/h5-8,12,15-17,24H,3-4,9-11,21H2,1-2H3,(H,22,25)(H,27,28)