1-[[3-benzamido-2-oxidanyl-7-(phenylmethoxycarbonylamino)heptyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[3-benzamido-2-oxidanyl-7-(phenylmethoxycarbonylamino)heptyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[3-benzamido-7-(benzyloxycarbonylamino)-2-hydroxy-heptyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[[3-benzamido-2-hydroxy-7-(phenylmethoxycarbonylamino)heptyl]-methylamino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[3-benzamido-2-hydroxy-7-(phenylmethoxycarbonylamino)heptyl]-methylcarbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[3-benzamido-7-(benzyloxycarbonylamino)-2-hydroxy-heptyl]-methyl-carbamoyl]proline Formula: C29H38N4O7 MolecularWeight: 554.63462

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C(CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2)O)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CN(CC(C(CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2)O)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C29H38N4O7/c1-32(29(39)33-18-10-16-24(33)27(36)37)19-25(34)23(31-26(35)22-13-6-3-7-14-22)15-8-9-17-30-28(38)40-20-21-11-4-2-5-12-21/h2-7,11-14,23-25,34H,8-10,15-20H2,1H3,(H,30,38)(H,31,35)(H,36,37)