ethyl (E)-7-azanyl-4-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]-7-oxidanylidene-hept-2-enoate

Systemtic Name: ethyl (E)-7-azanyl-4-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]-7-oxidanylidene-hept-2-enoate Openeye Name: ethyl (E)-7-amino-4-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]-7-oxo-hept-2-enoate CAS Name: (E)-7-amino-4-[[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]amino]-7-oxo-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-amino-4-[(5-methyl-2-phenyltriazole-4-carbonyl)amino]-7-oxohept-2-enoate Traditional Name: (E)-7-amino-7-keto-4-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]hept-2-enoic acid ethyl ester Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CCC(=O)N)NC(=O)C1=NN(N=C1C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/C(CCC(=O)N)NC(=O)C1=NN(N=C1C)C2=CC=CC=C2

InChI

InChI=1S/C19H23N5O4/c1-3-28-17(26)12-10-14(9-11-16(20)25)21-19(27)18-13(2)22-24(23-18)15-7-5-4-6-8-15/h4-8,10,12,14H,3,9,11H2,1-2H3,(H2,20,25)(H,21,27)/b12-10+