methyl 4-diethoxyphosphoryl-2-methyl-4-(3-naphthalen-2-ylprop-2-ynyl)-5-oxidanylidene-1-(phenylcarbamoylamino)pyrrole-3-carboxylate

Systemtic Name: methyl 4-diethoxyphosphoryl-2-methyl-4-(3-naphthalen-2-ylprop-2-ynyl)-5-oxidanylidene-1-(phenylcarbamoylamino)pyrrole-3-carboxylate Openeye Name: methyl 4-diethoxyphosphoryl-2-methyl-4-[3-(2-naphthyl)prop-2-ynyl]-5-oxo-1-(phenylcarbamoylamino)pyrrole-3-carboxylate CAS Name: 1-[[anilino(oxo)methyl]amino]-4-diethoxyphosphoryl-2-methyl-4-[3-(2-naphthalenyl)prop-2-ynyl]-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-diethoxyphosphoryl-2-methyl-4-(3-naphthalen-2-ylprop-2-ynyl)-5-oxo-1-(phenylcarbamoylamino)pyrrole-3-carboxylate Traditional Name: 4-diethoxyphosphoryl-5-keto-2-methyl-4-[3-(2-naphthyl)prop-2-ynyl]-1-(phenylcarbamoylamino)-2-pyrroline-3-carboxylic acid methyl ester Formula: C31H32N3O7P MolecularWeight: 589.575441

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1(C(=C(N(C1=O)NC(=O)NC2=CC=CC=C2)C)C(=O)OC)CC#CC3=CC4=CC=CC=C4C=C3)OCC

Isomeric SMILES

CCOP(=O)(C1(C(=C(N(C1=O)NC(=O)NC2=CC=CC=C2)C)C(=O)OC)CC#CC3=CC4=CC=CC=C4C=C3)OCC

InChI

InChI=1S/C31H32N3O7P/c1-5-40-42(38,41-6-2)31(20-12-13-23-18-19-24-14-10-11-15-25(24)21-23)27(28(35)39-4)22(3)34(29(31)36)33-30(37)32-26-16-8-7-9-17-26/h7-11,14-19,21H,5-6,20H2,1-4H3,(H2,32,33,37)