ethoxy-[2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-4-methyl-pentyl]phosphinic acid

Systemtic Name: ethoxy-[2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-4-methyl-pentyl]phosphinic acid Openeye Name: ethoxy-[2-[[(1S)-1-(1H-indol-3-ylmethyl)-2-methoxy-2-oxo-ethyl]carbamoyl]-4-methyl-pentyl]phosphinic acid CAS Name: ethoxy-[2-[[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]-4-methylpentyl]phosphinic acid IUPAC Name: ethoxy-[2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]-4-methylpentyl]phosphinic acid Traditional Name: ethoxy-[2-[[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-methoxy-ethyl]carbamoyl]-4-methyl-pentyl]phosphinic acid Formula: C21H31N2O6P MolecularWeight: 438.454401

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(CC(C)C)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)O

Isomeric SMILES

CCOP(=O)(CC(CC(C)C)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OC)O

InChI

InChI=1S/C21H31N2O6P/c1-5-29-30(26,27)13-16(10-14(2)3)20(24)23-19(21(25)28-4)11-15-12-22-18-9-7-6-8-17(15)18/h6-9,12,14,16,19,22H,5,10-11,13H2,1-4H3,(H,23,24)(H,26,27)/t16?,19-/m0/s1