methyl 2-[[4-(methylamino)phenyl]carbonylamino]-6-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: methyl 2-[[4-(methylamino)phenyl]carbonylamino]-6-(phenylmethoxycarbonylamino)hexanoate Openeye Name: methyl 6-(benzyloxycarbonylamino)-2-[[4-(methylamino)benzoyl]amino]hexanoate CAS Name: 2-[[[4-(methylamino)phenyl]-oxomethyl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid methyl ester IUPAC Name: methyl 2-[[4-(methylamino)benzoyl]amino]-6-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 6-(benzyloxycarbonylamino)-2-[[4-(methylamino)benzoyl]amino]hexanoic acid methyl ester Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)C(=O)NC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CNC1=CC=C(C=C1)C(=O)NC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C23H29N3O5/c1-24-19-13-11-18(12-14-19)21(27)26-20(22(28)30-2)10-6-7-15-25-23(29)31-16-17-8-4-3-5-9-17/h3-5,8-9,11-14,20,24H,6-7,10,15-16H2,1-2H3,(H,25,29)(H,26,27)