ethyl (E)-4-[(6-bromanyl-2H-chromen-3-yl)carbonylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate

Systemtic Name: ethyl (E)-4-[(6-bromanyl-2H-chromen-3-yl)carbonylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate Openeye Name: ethyl (E)-4-[(6-bromo-2H-chromene-3-carbonyl)amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate CAS Name: (E)-4-[[(6-bromo-2H-1-benzopyran-3-yl)-oxomethyl]amino]-5-(2-oxo-3-pyrrolidinyl)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(6-bromo-2H-chromene-3-carbonyl)amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate Traditional Name: (E)-4-[(6-bromo-2H-chromene-3-carbonyl)amino]-5-(2-ketopyrrolidin-3-yl)pent-2-enoic acid ethyl ester Formula: C21H23BrN2O5 MolecularWeight: 463.32172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1CCNC1=O)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2

Isomeric SMILES

CCOC(=O)/C=C/C(CC1CCNC1=O)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2

InChI

InChI=1S/C21H23BrN2O5/c1-2-28-19(25)6-4-17(11-13-7-8-23-20(13)26)24-21(27)15-9-14-10-16(22)3-5-18(14)29-12-15/h3-6,9-10,13,17H,2,7-8,11-12H2,1H3,(H,23,26)(H,24,27)/b6-4+