4-[4-[1-[(3-diphenylphosphanyl-4-methoxycarbonyl-phenyl)carbonylamino]ethyl]-2-methoxy-5-nitro-phenoxy]butanoic acid

Systemtic Name: 4-[4-[1-[(3-diphenylphosphanyl-4-methoxycarbonyl-phenyl)carbonylamino]ethyl]-2-methoxy-5-nitro-phenoxy]butanoic acid Openeye Name: 4-[4-[1-[(3-diphenylphosphanyl-4-methoxycarbonyl-benzoyl)amino]ethyl]-2-methoxy-5-nitro-phenoxy]butanoic acid CAS Name: 4-[4-[1-[[(3-diphenylphosphino-4-methoxycarbonylphenyl)-oxomethyl]amino]ethyl]-2-methoxy-5-nitrophenoxy]butanoic acid IUPAC Name: 4-[4-[1-[(3-diphenylphosphanyl-4-methoxycarbonylbenzoyl)amino]ethyl]-2-methoxy-5-nitrophenoxy]butanoic acid Traditional Name: 4-[4-[1-[(4-carbomethoxy-3-diphenylphosphino-benzoyl)amino]ethyl]-2-methoxy-5-nitro-phenoxy]butyric acid Formula: C34H33N2O9P MolecularWeight: 644.607581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)O)OC)NC(=O)C2=CC(=C(C=C2)C(=O)OC)P(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)O)OC)NC(=O)C2=CC(=C(C=C2)C(=O)OC)P(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C34H33N2O9P/c1-22(27-20-29(43-2)30(21-28(27)36(41)42)45-18-10-15-32(37)38)35-33(39)23-16-17-26(34(40)44-3)31(19-23)46(24-11-6-4-7-12-24)25-13-8-5-9-14-25/h4-9,11-14,16-17,19-22H,10,15,18H2,1-3H3,(H,35,39)(H,37,38)