(phenylmethyl) 2-[[1-[2-(2-azanylpropanoylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[[1-[2-(2-azanylpropanoylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-butanoate Openeye Name: benzyl 2-[[1-[2-(2-aminopropanoylamino)propanoyl]pyrrolidine-2-carbonyl]amino]-3-methyl-butanoate CAS Name: 2-[[[1-[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[1-[2-(2-aminopropanoylamino)propanoyl]pyrrolidine-2-carbonyl]amino]-3-methylbutanoate Traditional Name: 2-[[1-[2-(alanylamino)propanoyl]prolyl]amino]-3-methyl-butyric acid benzyl ester Formula: C23H34N4O5 MolecularWeight: 446.53986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C2CCCN2C(=O)C(C)NC(=O)C(C)N

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C2CCCN2C(=O)C(C)NC(=O)C(C)N

InChI

InChI=1S/C23H34N4O5/c1-14(2)19(23(31)32-13-17-9-6-5-7-10-17)26-21(29)18-11-8-12-27(18)22(30)16(4)25-20(28)15(3)24/h5-7,9-10,14-16,18-19H,8,11-13,24H2,1-4H3,(H,25,28)(H,26,29)