tert-butyl 3-azulen-1-yl-2-chloranyl-3-oxidanyl-propanoate

Systemtic Name: tert-butyl 3-azulen-1-yl-2-chloranyl-3-oxidanyl-propanoate Openeye Name: tert-butyl 3-azulen-1-yl-2-chloro-3-hydroxy-propanoate CAS Name: 3-(1-azulenyl)-2-chloro-3-hydroxypropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-azulen-1-yl-2-chloro-3-hydroxypropanoate Traditional Name: 3-azulen-1-yl-2-chloro-3-hydroxy-propionic acid tert-butyl ester Formula: C17H19ClO3 MolecularWeight: 306.78396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(C1=C2C=CC=CC=C2C=C1)O)Cl

Isomeric SMILES

CC(C)(C)OC(=O)C(C(C1=C2C=CC=CC=C2C=C1)O)Cl

InChI

InChI=1S/C17H19ClO3/c1-17(2,3)21-16(20)14(18)15(19)13-10-9-11-7-5-4-6-8-12(11)13/h4-10,14-15,19H,1-3H3