ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxidanylidene-4H-quinoxaline-2-carboxylate

Systemtic Name: ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxidanylidene-4H-quinoxaline-2-carboxylate Openeye Name: ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxo-4H-quinoxaline-2-carboxylate CAS Name: 7-[3-[[[(4-ethoxycarbonylanilino)-oxomethyl]amino]methyl]-1-pyrrolyl]-6-methyl-3-oxo-4H-quinoxaline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxo-4H-quinoxaline-2-carboxylate Traditional Name: 7-[3-[[(4-carbethoxyphenyl)carbamoylamino]methyl]pyrrol-1-yl]-3-keto-6-methyl-4H-quinoxaline-2-carboxylic acid ethyl ester Formula: C27H27N5O6 MolecularWeight: 517.53318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=CN(C=C2)C3=CC4=C(C=C3C)NC(=O)C(=N4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=CN(C=C2)C3=CC4=C(C=C3C)NC(=O)C(=N4)C(=O)OCC

InChI

InChI=1S/C27H27N5O6/c1-4-37-25(34)18-6-8-19(9-7-18)29-27(36)28-14-17-10-11-32(15-17)22-13-21-20(12-16(22)3)31-24(33)23(30-21)26(35)38-5-2/h6-13,15H,4-5,14H2,1-3H3,(H,31,33)(H2,28,29,36)