(phenylmethyl) 2-[azanyl(pyrrolidin-2-ylmethyl)carbamoyl]butanoate

Systemtic Name: (phenylmethyl) 2-[azanyl(pyrrolidin-2-ylmethyl)carbamoyl]butanoate Openeye Name: benzyl 2-[amino(pyrrolidin-2-ylmethyl)carbamoyl]butanoate CAS Name: 2-[[amino(2-pyrrolidinylmethyl)amino]-oxomethyl]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[amino(pyrrolidin-2-ylmethyl)carbamoyl]butanoate Traditional Name: 2-[amino(pyrrolidin-2-ylmethyl)carbamoyl]butyric acid benzyl ester Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CC1CCCN1)N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)N(CC1CCCN1)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H25N3O3/c1-2-15(16(21)20(18)11-14-9-6-10-19-14)17(22)23-12-13-7-4-3-5-8-13/h3-5,7-8,14-15,19H,2,6,9-12,18H2,1H3