(phenylmethyl) 2-[2-(3-methylphenyl)ethoxycarbonylamino]-5-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (phenylmethyl) 2-[2-(3-methylphenyl)ethoxycarbonylamino]-5-(phenylmethoxycarbonylamino)pentanoate Openeye Name: benzyl 5-(benzyloxycarbonylamino)-2-[2-(m-tolyl)ethoxycarbonylamino]pentanoate CAS Name: 2-[[2-(3-methylphenyl)ethoxy-oxomethyl]amino]-5-(phenylmethoxycarbonylamino)pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(3-methylphenyl)ethoxycarbonylamino]-5-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 5-(benzyloxycarbonylamino)-2-[2-(m-tolyl)ethoxycarbonylamino]valeric acid benzyl ester Formula: C30H34N2O6 MolecularWeight: 518.60076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCOC(=O)NC(CCCNC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)CCOC(=O)NC(CCCNC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C30H34N2O6/c1-23-10-8-15-24(20-23)17-19-36-30(35)32-27(28(33)37-21-25-11-4-2-5-12-25)16-9-18-31-29(34)38-22-26-13-6-3-7-14-26/h2-8,10-15,20,27H,9,16-19,21-22H2,1H3,(H,31,34)(H,32,35)