(phenylmethyl) N-[1-(2-azanylbutanoyl)pyrrolidin-2-yl]carbonyl-N-(2-methylbutyl)carbamate

Systemtic Name: (phenylmethyl) N-[1-(2-azanylbutanoyl)pyrrolidin-2-yl]carbonyl-N-(2-methylbutyl)carbamate Openeye Name: benzyl N-[1-(2-aminobutanoyl)pyrrolidine-2-carbonyl]-N-(2-methylbutyl)carbamate CAS Name: N-[[1-(2-amino-1-oxobutyl)-2-pyrrolidinyl]-oxomethyl]-N-(2-methylbutyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(2-aminobutanoyl)pyrrolidine-2-carbonyl]-N-(2-methylbutyl)carbamate Traditional Name: N-[1-(2-aminobutanoyl)prolyl]-N-(2-methylbutyl)carbamic acid benzyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(C(=O)C1CCCN1C(=O)C(CC)N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)CN(C(=O)C1CCCN1C(=O)C(CC)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H33N3O4/c1-4-16(3)14-25(22(28)29-15-17-10-7-6-8-11-17)21(27)19-12-9-13-24(19)20(26)18(23)5-2/h6-8,10-11,16,18-19H,4-5,9,12-15,23H2,1-3H3