2-[[6-azanyl-2-[bis(phenylmethoxycarbonyl)amino]hexanoyl]amino]-3-methyl-pentanoic acid

Systemtic Name: 2-[[6-azanyl-2-[bis(phenylmethoxycarbonyl)amino]hexanoyl]amino]-3-methyl-pentanoic acid Openeye Name: 2-[[6-amino-2-[bis(benzyloxycarbonyl)amino]hexanoyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[6-amino-2-[bis(phenylmethoxycarbonyl)amino]-1-oxohexyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[6-amino-2-[bis(phenylmethoxycarbonyl)amino]hexanoyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[6-amino-2-(dicarbobenzoxyamino)hexanoyl]amino]-3-methyl-valeric acid Formula: C28H37N3O7 MolecularWeight: 527.60928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(CCCCN)N(C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C(CCCCN)N(C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C28H37N3O7/c1-3-20(2)24(26(33)34)30-25(32)23(16-10-11-17-29)31(27(35)37-18-21-12-6-4-7-13-21)28(36)38-19-22-14-8-5-9-15-22/h4-9,12-15,20,23-24H,3,10-11,16-19,29H2,1-2H3,(H,30,32)(H,33,34)