methyl 5-tert-butyl-3-[[4-[2-(3,4-dimethoxyphenyl)ethoxy]naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[[4-[2-(3,4-dimethoxyphenyl)ethoxy]naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[[4-[2-(3,4-dimethoxyphenyl)ethoxy]-1-naphthyl]carbamoylamino]-1H-pyrrole-2-carboxylate CAS Name: 5-tert-butyl-3-[[[[4-[2-(3,4-dimethoxyphenyl)ethoxy]-1-naphthalenyl]amino]-oxomethyl]amino]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[[4-[2-(3,4-dimethoxyphenyl)ethoxy]naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxylate Traditional Name: 5-tert-butyl-3-[(4-homoveratryloxy-1-naphthyl)carbamoylamino]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C31H35N3O6 MolecularWeight: 545.6261

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(N1)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C)(C)C1=CC(=C(N1)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C31H35N3O6/c1-31(2,3)27-18-23(28(34-27)29(35)39-6)33-30(36)32-22-12-14-24(21-10-8-7-9-20(21)22)40-16-15-19-11-13-25(37-4)26(17-19)38-5/h7-14,17-18,34H,15-16H2,1-6H3,(H2,32,33,36)