2-[(2-methoxycarbonylphenyl)methylcarbamoyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]ethanoic acid

Systemtic Name: 2-[(2-methoxycarbonylphenyl)methylcarbamoyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]ethanoic acid Openeye Name: 2-[3-(tert-butoxycarbonylamino)propyl-[(2-methoxycarbonylphenyl)methylcarbamoyl]amino]acetic acid CAS Name: 2-[[[(2-methoxycarbonylphenyl)methylamino]-oxomethyl]-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]amino]acetic acid IUPAC Name: 2-[(2-methoxycarbonylphenyl)methylcarbamoyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]acetic acid Traditional Name: 2-[3-(tert-butoxycarbonylamino)propyl-[(2-carbomethoxybenzyl)carbamoyl]amino]acetic acid Formula: C20H29N3O7 MolecularWeight: 423.46016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCN(CC(=O)O)C(=O)NCC1=CC=CC=C1C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCCN(CC(=O)O)C(=O)NCC1=CC=CC=C1C(=O)OC

InChI

InChI=1S/C20H29N3O7/c1-20(2,3)30-19(28)21-10-7-11-23(13-16(24)25)18(27)22-12-14-8-5-6-9-15(14)17(26)29-4/h5-6,8-9H,7,10-13H2,1-4H3,(H,21,28)(H,22,27)(H,24,25)