(E)-4-[(5-methyl-1H-indol-2-yl)carbonylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoic acid

Systemtic Name: (E)-4-[(5-methyl-1H-indol-2-yl)carbonylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoic acid Openeye Name: (E)-4-[(5-methyl-1H-indole-2-carbonyl)amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoic acid CAS Name: (E)-4-[[(5-methyl-1H-indol-2-yl)-oxomethyl]amino]-5-(2-oxo-3-pyrrolidinyl)-2-pentenoic acid IUPAC Name: (E)-4-[(5-methyl-1H-indole-2-carbonyl)amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoic acid Traditional Name: (E)-5-(2-ketopyrrolidin-3-yl)-4-[(5-methyl-1H-indole-2-carbonyl)amino]pent-2-enoic acid Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2)C(=O)NC(CC3CCNC3=O)C=CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2)C(=O)NC(CC3CCNC3=O)/C=C/C(=O)O

InChI

InChI=1S/C19H21N3O4/c1-11-2-4-15-13(8-11)10-16(22-15)19(26)21-14(3-5-17(23)24)9-12-6-7-20-18(12)25/h2-5,8,10,12,14,22H,6-7,9H2,1H3,(H,20,25)(H,21,26)(H,23,24)/b5-3+