ethyl (E)-4-(2H-chromen-3-ylcarbonylamino)-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate

Systemtic Name: ethyl (E)-4-(2H-chromen-3-ylcarbonylamino)-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate Openeye Name: ethyl (E)-4-(2H-chromene-3-carbonylamino)-5-(2-oxopyrrolidin-3-yl)pent-2-enoate CAS Name: (E)-4-[[2H-1-benzopyran-3-yl(oxo)methyl]amino]-5-(2-oxo-3-pyrrolidinyl)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(2H-chromene-3-carbonylamino)-5-(2-oxopyrrolidin-3-yl)pent-2-enoate Traditional Name: (E)-4-(2H-chromene-3-carbonylamino)-5-(2-ketopyrrolidin-3-yl)pent-2-enoic acid ethyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1CCNC1=O)NC(=O)C2=CC3=CC=CC=C3OC2

Isomeric SMILES

CCOC(=O)/C=C/C(CC1CCNC1=O)NC(=O)C2=CC3=CC=CC=C3OC2

InChI

InChI=1S/C21H24N2O5/c1-2-27-19(24)8-7-17(12-15-9-10-22-20(15)25)23-21(26)16-11-14-5-3-4-6-18(14)28-13-16/h3-8,11,15,17H,2,9-10,12-13H2,1H3,(H,22,25)(H,23,26)/b8-7+