3-[[2-[2-(3-hydroxyphenyl)-5-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]carbamoylamino]benzoate

Systemtic Name: 3-[[2-[2-(3-hydroxyphenyl)-5-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]carbamoylamino]benzoate Openeye Name: 3-[[2-[2-(3-hydroxyphenyl)-5-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethyl]carbamoylamino]benzoate CAS Name: 3-[[[[2-[2-(3-hydroxyphenyl)-5-(3-methoxyphenyl)-1-pyrrolidinyl]-2-oxoethyl]amino]-oxomethyl]amino]benzoate IUPAC Name: 3-[[2-[2-(3-hydroxyphenyl)-5-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]carbamoylamino]benzoate Traditional Name: 3-[[2-[2-(3-hydroxyphenyl)-5-(3-methoxyphenyl)pyrrolidino]-2-keto-ethyl]carbamoylamino]benzoate Formula: C27H26N3O6- MolecularWeight: 488.51184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCC(N2C(=O)CNC(=O)NC3=CC=CC(=C3)C(=O)[O-])C4=CC(=CC=C4)O

Isomeric SMILES

COC1=CC=CC(=C1)C2CCC(N2C(=O)CNC(=O)NC3=CC=CC(=C3)C(=O)[O-])C4=CC(=CC=C4)O

InChI

InChI=1S/C27H27N3O6/c1-36-22-10-4-6-18(15-22)24-12-11-23(17-5-3-9-21(31)14-17)30(24)25(32)16-28-27(35)29-20-8-2-7-19(13-20)26(33)34/h2-10,13-15,23-24,31H,11-12,16H2,1H3,(H,33,34)(H2,28,29,35)/p-1