(Z)-2-[(2-methyl-5-phenyl-furan-3-yl)carbonylamino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid

Systemtic Name: (Z)-2-[(2-methyl-5-phenyl-furan-3-yl)carbonylamino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid Openeye Name: (Z)-2-[(2-methyl-5-phenyl-furan-3-carbonyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid CAS Name: (Z)-2-[[(2-methyl-5-phenyl-3-furanyl)-oxomethyl]amino]-5-[(3S)-2-oxo-3-pyrrolidinyl]-2-pentenoic acid IUPAC Name: (Z)-2-[(2-methyl-5-phenylfuran-3-carbonyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid Traditional Name: (Z)-5-[(3S)-2-ketopyrrolidin-3-yl]-2-[(2-methyl-5-phenyl-3-furoyl)amino]pent-2-enoic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)NC(=CCCC3CCNC3=O)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)N/C(=C\CC[C@H]3CCNC3=O)/C(=O)O

InChI

InChI=1S/C21H22N2O5/c1-13-16(12-18(28-13)14-6-3-2-4-7-14)20(25)23-17(21(26)27)9-5-8-15-10-11-22-19(15)24/h2-4,6-7,9,12,15H,5,8,10-11H2,1H3,(H,22,24)(H,23,25)(H,26,27)/b17-9-/t15-/m0/s1