5-azulen-1-yl-3-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]pentanoic acid

Systemtic Name: 5-azulen-1-yl-3-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]pentanoic acid Openeye Name: 5-azulen-1-yl-3-[[1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]pentanoic acid CAS Name: 5-(1-azulenyl)-3-[[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]pentanoic acid IUPAC Name: 5-azulen-1-yl-3-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]pentanoic acid Traditional Name: 5-azulen-1-yl-3-[[1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]valeric acid Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(CC1=CC=CC=C1)NC(=O)C(CCC2=C3C=CC=CC=C3C=C2)CC(=O)O

Isomeric SMILES

CNC(=O)C(CC1=CC=CC=C1)NC(=O)C(CCC2=C3C=CC=CC=C3C=C2)CC(=O)O

InChI

InChI=1S/C26H28N2O4/c1-27-26(32)23(16-18-8-4-2-5-9-18)28-25(31)21(17-24(29)30)15-14-20-13-12-19-10-6-3-7-11-22(19)20/h2-13,21,23H,14-17H2,1H3,(H,27,32)(H,28,31)(H,29,30)