(phenylmethyl) 2-[[nitroso(prop-2-ynyl)carbamoyl]amino]-5-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (phenylmethyl) 2-[[nitroso(prop-2-ynyl)carbamoyl]amino]-5-(phenylmethoxycarbonylamino)pentanoate Openeye Name: benzyl 5-(benzyloxycarbonylamino)-2-[[nitroso(prop-2-ynyl)carbamoyl]amino]pentanoate CAS Name: 2-[[[nitroso(prop-2-ynyl)amino]-oxomethyl]amino]-5-(phenylmethoxycarbonylamino)pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[nitroso(prop-2-ynyl)carbamoyl]amino]-5-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 5-(benzyloxycarbonylamino)-2-[[nitroso(propargyl)carbamoyl]amino]valeric acid benzyl ester Formula: C24H26N4O6 MolecularWeight: 466.48644

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C(=O)NC(CCCNC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)N=O

Isomeric SMILES

C#CCN(C(=O)NC(CCCNC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)N=O

InChI

InChI=1S/C24H26N4O6/c1-2-16-28(27-32)23(30)26-21(22(29)33-17-19-10-5-3-6-11-19)14-9-15-25-24(31)34-18-20-12-7-4-8-13-20/h1,3-8,10-13,21H,9,14-18H2,(H,25,31)(H,26,30)