phenylmethoxycarbonyl 2-azanyl-4-methyl-2-(2-nitrosopyrrolidin-1-yl)pentanoate

Systemtic Name: phenylmethoxycarbonyl 2-azanyl-4-methyl-2-(2-nitrosopyrrolidin-1-yl)pentanoate Openeye Name: benzyloxycarbonyl 2-amino-4-methyl-2-(2-nitrosopyrrolidin-1-yl)pentanoate CAS Name: 2-amino-4-methyl-2-(2-nitroso-1-pyrrolidinyl)pentanoic acid phenylmethoxycarbonyl ester IUPAC Name: phenylmethoxycarbonyl 2-amino-4-methyl-2-(2-nitrosopyrrolidin-1-yl)pentanoate Traditional Name: 2-amino-4-methyl-2-(2-nitrosopyrrolidino)valeric acid carbobenzoxy ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(=O)OCC1=CC=CC=C1)(N)N2CCCC2N=O

Isomeric SMILES

CC(C)CC(C(=O)OC(=O)OCC1=CC=CC=C1)(N)N2CCCC2N=O

InChI

InChI=1S/C18H25N3O5/c1-13(2)11-18(19,21-10-6-9-15(21)20-24)16(22)26-17(23)25-12-14-7-4-3-5-8-14/h3-5,7-8,13,15H,6,9-12,19H2,1-2H3