1-[2-[(3-benzamido-2-oxidanylidene-heptyl)-phenylmethoxycarbonyl-amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(3-benzamido-2-oxidanylidene-heptyl)-phenylmethoxycarbonyl-amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(3-benzamido-2-oxo-heptyl)-benzyloxycarbonyl-amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(3-benzamido-2-oxoheptyl)-phenylmethoxycarbonylamino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(3-benzamido-2-oxoheptyl)-phenylmethoxycarbonylamino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(3-benzamido-2-keto-heptyl)-carbobenzoxy-amino]propanoyl]proline Formula: C30H37N3O7 MolecularWeight: 551.63068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)CN(C(C)C(=O)N1CCCC1C(=O)O)C(=O)OCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC(C(=O)CN(C(C)C(=O)N1CCCC1C(=O)O)C(=O)OCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C30H37N3O7/c1-3-4-16-24(31-27(35)23-14-9-6-10-15-23)26(34)19-33(30(39)40-20-22-12-7-5-8-13-22)21(2)28(36)32-18-11-17-25(32)29(37)38/h5-10,12-15,21,24-25H,3-4,11,16-20H2,1-2H3,(H,31,35)(H,37,38)