3-[(3Z)-3-(5-chloranyl-1,2-dihydrobenzotriazol-4-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]propyl 2-methylprop-2-enoate

Systemtic Name: 3-[(3Z)-3-(5-chloranyl-1,2-dihydrobenzotriazol-4-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]propyl 2-methylprop-2-enoate Openeye Name: 3-[(3Z)-3-(5-chloro-1,2-dihydrobenzotriazol-4-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]propyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 3-[(3Z)-3-(5-chloro-1,2-dihydrobenzotriazol-4-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]propyl ester IUPAC Name: 3-[(3Z)-3-(5-chloro-1,2-dihydrobenzotriazol-4-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]propyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 3-[(3Z)-3-(5-chloro-1,2-dihydrobenzotriazol-4-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]propyl ester Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCCC1=CC(=C2C(=CC=C3C2=NNN3)Cl)C(=O)C=C1

Isomeric SMILES

CC(=C)C(=O)OCCCC1=C/C(=C\2/C(=CC=C3C2=NNN3)Cl)/C(=O)C=C1

InChI

InChI=1S/C19H18ClN3O3/c1-11(2)19(25)26-9-3-4-12-5-8-16(24)13(10-12)17-14(20)6-7-15-18(17)22-23-21-15/h5-8,10,21,23H,1,3-4,9H2,2H3/b17-13+